[[4-[[2,4-bis(oxidanyl)phenyl]carbonyldiazenyl]phenyl]amino] 3-nitrobenzoate

Systemtic Name: [[4-[[2,4-bis(oxidanyl)phenyl]carbonyldiazenyl]phenyl]amino] 3-nitrobenzoate Openeye Name: [4-(2,4-dihydroxybenzoyl)azoanilino] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [4-[(2,4-dihydroxyphenyl)-oxomethyl]azoanilino] ester IUPAC Name: [4-[(2,4-dihydroxybenzoyl)diazenyl]anilino] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [4-(2,4-dihydroxybenzoyl)azoanilino] ester Formula: C20H14N4O7 MolecularWeight: 422.34776

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)ONC2=CC=C(C=C2)N=NC(=O)C3=C(C=C(C=C3)O)O

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)ONC2=CC=C(C=C2)N=NC(=O)C3=C(C=C(C=C3)O)O

InChI

InChI=1S/C20H14N4O7/c25-16-8-9-17(18(26)11-16)19(27)22-21-13-4-6-14(7-5-13)23-31-20(28)12-2-1-3-15(10-12)24(29)30/h1-11,23,25-26H