[[4-[(2,4-dinitrophenyl)carbonyldiazenyl]phenyl]amino] 3-methoxybenzoate

Systemtic Name: [[4-[(2,4-dinitrophenyl)carbonyldiazenyl]phenyl]amino] 3-methoxybenzoate Openeye Name: [4-(2,4-dinitrobenzoyl)azoanilino] 3-methoxybenzoate CAS Name: 3-methoxybenzoic acid [4-[(2,4-dinitrophenyl)-oxomethyl]azoanilino] ester IUPAC Name: [4-[(2,4-dinitrobenzoyl)diazenyl]anilino] 3-methoxybenzoate Traditional Name: 3-methoxybenzoic acid [4-(2,4-dinitrobenzoyl)azoanilino] ester Formula: C21H15N5O8 MolecularWeight: 465.3725

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)ONC2=CC=C(C=C2)N=NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)ONC2=CC=C(C=C2)N=NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H15N5O8/c1-33-17-4-2-3-13(11-17)21(28)34-24-15-7-5-14(6-8-15)22-23-20(27)18-10-9-16(25(29)30)12-19(18)26(31)32/h2-12,24H,1H3