1XY

(4R)-3,4-dihydro-2H-chromen-4-amine

Created:	2013-07-30
Last modified:	2024-09-27

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1 entries where 1XY is found in a polymer sequence

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Chemical Details
Formal Charge	0
Atom Count	22
Chiral Atom Count	1
Bond Count	23
Aromatic Bond Count	6

2D diagram of 1XY

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Chemical Component Summary
Name	(4R)-3,4-dihydro-2H-chromen-4-amine
Systematic Name (OpenEye OEToolkits)	(4R)-3,4-dihydro-2H-chromen-4-amine
Formula	C₉ H₁₁ N O
Molecular Weight	149.19
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O2c1ccccc1C(N)CC2
SMILES	CACTVS	3.385	N[CH]1CCOc2ccccc12
SMILES	OpenEye OEToolkits	1.7.6	c1ccc2c(c1)C(CCO2)N
Canonical SMILES	CACTVS	3.385	N[C@@H]1CCOc2ccccc12
Canonical SMILES	OpenEye OEToolkits	1.7.6	c1ccc2c(c1)[C@@H](CCO2)N
InChI	InChI	1.03	InChI=1S/C9H11NO/c10-8-5-6-11-9-4-2-1-3-7(8)9/h1-4,8H,5-6,10H2/t8-/m1/s1
InChIKey	InChI	1.03	LCOFMNJNNXWKOC-MRVPVSSYSA-N

Related Resource References

Resource Name	Reference
PubChem	7065430

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