2-[[2-methoxy-4-[(4-nitrophenyl)diazenyl]phenyl]amino]butanedioic acid

Systemtic Name: 2-[[2-methoxy-4-[(4-nitrophenyl)diazenyl]phenyl]amino]butanedioic acid Openeye Name: 2-[2-methoxy-4-(4-nitrophenyl)azo-anilino]butanedioic acid CAS Name: 2-[2-methoxy-4-(4-nitrophenyl)azoanilino]butanedioic acid IUPAC Name: 2-[2-methoxy-4-[(4-nitrophenyl)diazenyl]anilino]butanedioic acid Traditional Name: 2-[2-methoxy-4-(4-nitrophenyl)azo-anilino]succinic acid Formula: C17H16N4O7 MolecularWeight: 388.33154

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)N=NC2=CC=C(C=C2)[N+](=O)[O-])NC(CC(=O)O)C(=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)N=NC2=CC=C(C=C2)[N+](=O)[O-])NC(CC(=O)O)C(=O)O

InChI

InChI=1S/C17H16N4O7/c1-28-15-8-11(20-19-10-2-5-12(6-3-10)21(26)27)4-7-13(15)18-14(17(24)25)9-16(22)23/h2-8,14,18H,9H2,1H3,(H,22,23)(H,24,25)