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2-[(4-butoxy-2-nitro-phenyl)diazenyl]-3-oxidanylidene-butanoic acid

2-[(4-butoxy-2-nitro-phenyl)diazenyl]-3-oxidanylidene-butanoic acid

Systemtic Name:2-[(4-butoxy-2-nitro-phenyl)diazenyl]-3-oxidanylidene-butanoic acid
Openeye Name:2-(4-butoxy-2-nitro-phenyl)azo-3-oxo-butanoic acid
CAS Name:2-(4-butoxy-2-nitrophenyl)azo-3-oxobutanoic acid
IUPAC Name:2-[(4-butoxy-2-nitrophenyl)diazenyl]-3-oxobutanoic acid
Traditional Name:2-(4-butoxy-2-nitro-phenyl)azo-3-keto-butyric acid
Formula: C14H17N3O6
MolecularWeight: 323.30128
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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC(=C(C=C1)N=NC(C(=O)C)C(=O)O)[N+](=O)[O-]


Isomeric SMILES

CCCCOC1=CC(=C(C=C1)N=NC(C(=O)C)C(=O)O)[N+](=O)[O-]


InChI

InChI=1S/C14H17N3O6/c1-3-4-7-23-10-5-6-11(12(8-10)17(21)22)15-16-13(9(2)18)14(19)20/h5-6,8,13H,3-4,7H2,1-2H3,(H,19,20)


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