[[4-[(2-bromanyl-3-nitro-phenyl)carbonyldiazenyl]phenyl]amino] benzoate

Systemtic Name: [[4-[(2-bromanyl-3-nitro-phenyl)carbonyldiazenyl]phenyl]amino] benzoate Openeye Name: [4-(2-bromo-3-nitro-benzoyl)azoanilino] benzoate CAS Name: benzoic acid [4-[(2-bromo-3-nitrophenyl)-oxomethyl]azoanilino] ester IUPAC Name: [4-[(2-bromo-3-nitrobenzoyl)diazenyl]anilino] benzoate Traditional Name: benzoic acid [4-(2-bromo-3-nitro-benzoyl)azoanilino] ester Formula: C20H13BrN4O5 MolecularWeight: 469.24502

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H13BrN4O5/c21-18-16(7-4-8-17(18)25(28)29)19(26)23-22-14-9-11-15(12-10-14)24-30-20(27)13-5-2-1-3-6-13/h1-12,24H