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

Systemtic Name: [[4-[(3,5-dinitrophenyl)carbonyldiazenyl]phenyl]amino] 4-bromanylbenzoate Openeye Name: [4-(3,5-dinitrobenzoyl)azoanilino] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [4-[(3,5-dinitrophenyl)-oxomethyl]azoanilino] ester IUPAC Name: [4-[(3,5-dinitrobenzoyl)diazenyl]anilino] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [4-(3,5-dinitrobenzoyl)azoanilino] ester Formula: C20H12BrN5O7 MolecularWeight: 514.24258

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)ONC2=CC=C(C=C2)N=NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])Br

Isomeric SMILES

C1=CC(=CC=C1C(=O)ONC2=CC=C(C=C2)N=NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])Br

InChI

InChI=1S/C20H12BrN5O7/c21-14-3-1-12(2-4-14)20(28)33-24-16-7-5-15(6-8-16)22-23-19(27)13-9-17(25(29)30)11-18(10-13)26(31)32/h1-11,24H