ZFJ
(4aP)-N,N-diethyl-9,9-dimethyl-7-[(1E)-prop-1-en-1-yl]-9H-fluoren-2-amine
Created: | 2021-04-16 |
Last modified: | 2024-09-27 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 50 |
Chiral Atom Count | 0 |
Bond Count | 52 |
Aromatic Bond Count | 12 |
Chemical Component Summary | |
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Name | (4aP)-N,N-diethyl-9,9-dimethyl-7-[(1E)-prop-1-en-1-yl]-9H-fluoren-2-amine |
Systematic Name (OpenEye OEToolkits) | ~{N},~{N}-diethyl-9,9-dimethyl-7-[(~{E})-prop-1-enyl]fluoren-2-amine |
Formula | C22 H27 N |
Molecular Weight | 305.456 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | CCN(CC)c1ccc2c3ccc(cc3C(C)(C)c2c1)\C=C\C |
SMILES | CACTVS | 3.385 | CCN(CC)c1ccc2c3ccc(C=CC)cc3C(C)(C)c2c1 |
SMILES | OpenEye OEToolkits | 2.0.7 | CCN(CC)c1ccc-2c(c1)C(c3c2ccc(c3)C=CC)(C)C |
Canonical SMILES | CACTVS | 3.385 | CCN(CC)c1ccc2c3ccc(\C=C\C)cc3C(C)(C)c2c1 |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | CCN(CC)c1ccc-2c(c1)C(c3c2ccc(c3)/C=C/C)(C)C |
InChI | InChI | 1.03 | InChI=1S/C22H27N/c1-6-9-16-10-12-18-19-13-11-17(23(7-2)8-3)15-21(19)22(4,5)20(18)14-16/h6,9-15H,7-8H2,1-5H3/b9-6+ |
InChIKey | InChI | 1.03 | UMARKYXLRJLTSK-RMKNXTFCSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 162394540 |