[[4-[(2,4-dinitrophenyl)carbonyldiazenyl]phenyl]amino] 3,5-dinitrobenzoate

Systemtic Name: [[4-[(2,4-dinitrophenyl)carbonyldiazenyl]phenyl]amino] 3,5-dinitrobenzoate Openeye Name: [4-(2,4-dinitrobenzoyl)azoanilino] 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid [4-[(2,4-dinitrophenyl)-oxomethyl]azoanilino] ester IUPAC Name: [4-[(2,4-dinitrobenzoyl)diazenyl]anilino] 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid [4-(2,4-dinitrobenzoyl)azoanilino] ester Formula: C20H11N7O11 MolecularWeight: 525.34164

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NOC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])N=NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NOC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])N=NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H11N7O11/c28-19(17-6-5-14(24(30)31)10-18(17)27(36)37)22-21-12-1-3-13(4-2-12)23-38-20(29)11-7-15(25(32)33)9-16(8-11)26(34)35/h1-10,23H