4-[(3-bromophenyl)amino]-3-nitro-benzoate

Systemtic Name: 4-[(3-bromophenyl)amino]-3-nitro-benzoate Openeye Name: 4-(3-bromoanilino)-3-nitro-benzoate CAS Name: 4-(3-bromoanilino)-3-nitrobenzoate IUPAC Name: 4-(3-bromoanilino)-3-nitrobenzoate Traditional Name: 4-(3-bromoanilino)-3-nitro-benzoate Formula: C13H8BrN2O4- MolecularWeight: 336.11762

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)NC2=C(C=C(C=C2)C(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Br)NC2=C(C=C(C=C2)C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H9BrN2O4/c14-9-2-1-3-10(7-9)15-11-5-4-8(13(17)18)6-12(11)16(19)20/h1-7,15H,(H,17,18)/p-1