[[4-[(4-hydroxyphenyl)carbonyldiazenyl]phenyl]amino] 2,4-dinitrobenzoate

Systemtic Name: [[4-[(4-hydroxyphenyl)carbonyldiazenyl]phenyl]amino] 2,4-dinitrobenzoate Openeye Name: [4-(4-hydroxybenzoyl)azoanilino] 2,4-dinitrobenzoate CAS Name: 2,4-dinitrobenzoic acid [4-[(4-hydroxyphenyl)-oxomethyl]azoanilino] ester IUPAC Name: [4-[(4-hydroxybenzoyl)diazenyl]anilino] 2,4-dinitrobenzoate Traditional Name: 2,4-dinitrobenzoic acid [4-(4-hydroxybenzoyl)azoanilino] ester Formula: C20H13N5O8 MolecularWeight: 451.34592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)N=NC2=CC=C(C=C2)NOC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])O

Isomeric SMILES

C1=CC(=CC=C1C(=O)N=NC2=CC=C(C=C2)NOC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])O

InChI

InChI=1S/C20H13N5O8/c26-16-8-1-12(2-9-16)19(27)22-21-13-3-5-14(6-4-13)23-33-20(28)17-10-7-15(24(29)30)11-18(17)25(31)32/h1-11,23,26H