PXA

2-AMINO-1,9-DICARBONYL-4,6-DIMETHYL-10-DEHYDRO-3-OXO(8-AZA)PHENOXAZINE

Created:	1999-07-08
Last modified:	2024-09-27

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1 entries where PXA is found in a polymer sequence

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Chemical Details
Formal Charge	0
Atom Count	35
Chiral Atom Count	0
Bond Count	37
Aromatic Bond Count	6

2D diagram of PXA

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Chemical Component Summary
Name	2-AMINO-1,9-DICARBONYL-4,6-DIMETHYL-10-DEHYDRO-3-OXO(8-AZA)PHENOXAZINE
Synonyms	(8-AZA)PHENOXAZINE
Systematic Name (OpenEye OEToolkits)	8-azanyl-4,6-dimethyl-7-oxidanylidene-pyrido[4,3-b][1,4]benzoxazine-1,9-dicarboxylic acid
Formula	C₁₅ H₁₁ N₃ O₆
Molecular Weight	329.264
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=CC=2C1=Nc3c(ncc(c3OC1=C(C(=O)C=2N)C)C)C=O
SMILES	CACTVS	3.385	Cc1cnc(C(O)=O)c2N=C3C(=C(C)C(=O)C(=C3C(O)=O)N)Oc12
SMILES	OpenEye OEToolkits	2.0.7	Cc1cnc(c2c1OC3=C(C(=O)C(=C(C3=N2)C(=O)O)N)C)C(=O)O
Canonical SMILES	CACTVS	3.385	Cc1cnc(C(O)=O)c2N=C3C(=C(C)C(=O)C(=C3C(O)=O)N)Oc12
Canonical SMILES	OpenEye OEToolkits	2.0.7	Cc1cnc(c2c1OC3=C(C(=O)C(=C(C3=N2)C(=O)O)N)C)C(=O)O
InChI	InChI	1.06	InChI=1S/C15H11N3O6/c1-4-3-17-10(15(22)23)9-12(4)24-13-5(2)11(19)7(16)6(14(20)21)8(13)18-9/h3H,16H2,1-2H3,(H,20,21)(H,22,23)
InChIKey	InChI	1.06	HKYXOCMZOYRJAU-UHFFFAOYSA-N

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