[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl] 4-bromanyl-3-nitro-benzoate

Systemtic Name: [2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl] 4-bromanyl-3-nitro-benzoate Openeye Name: [2-(4-chloroanilino)-2-oxo-ethyl] 4-bromo-3-nitro-benzoate CAS Name: 4-bromo-3-nitrobenzoic acid [2-(4-chloroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-chloroanilino)-2-oxoethyl] 4-bromo-3-nitrobenzoate Traditional Name: 4-bromo-3-nitro-benzoic acid [2-(4-chloroanilino)-2-keto-ethyl] ester Formula: C15H10BrClN2O5 MolecularWeight: 413.6073

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)COC(=O)C2=CC(=C(C=C2)Br)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1NC(=O)COC(=O)C2=CC(=C(C=C2)Br)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H10BrClN2O5/c16-12-6-1-9(7-13(12)19(22)23)15(21)24-8-14(20)18-11-4-2-10(17)3-5-11/h1-7H,8H2,(H,18,20)