[2-[(2-methyl-6-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-[(3-bromophenyl)methoxy]benzoate

Systemtic Name: [2-[(2-methyl-6-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-[(3-bromophenyl)methoxy]benzoate Openeye Name: [2-(2-methyl-6-nitro-anilino)-2-oxo-ethyl] 2-[(3-bromophenyl)methoxy]benzoate CAS Name: 2-[(3-bromophenyl)methoxy]benzoic acid [2-(2-methyl-6-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-methyl-6-nitroanilino)-2-oxoethyl] 2-[(3-bromophenyl)methoxy]benzoate Traditional Name: 2-(3-bromobenzyl)oxybenzoic acid [2-keto-2-(2-methyl-6-nitro-anilino)ethyl] ester Formula: C23H19BrN2O6 MolecularWeight: 499.31076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)[N+](=O)[O-])NC(=O)COC(=O)C2=CC=CC=C2OCC3=CC(=CC=C3)Br

Isomeric SMILES

CC1=C(C(=CC=C1)[N+](=O)[O-])NC(=O)COC(=O)C2=CC=CC=C2OCC3=CC(=CC=C3)Br

InChI

InChI=1S/C23H19BrN2O6/c1-15-6-4-10-19(26(29)30)22(15)25-21(27)14-32-23(28)18-9-2-3-11-20(18)31-13-16-7-5-8-17(24)12-16/h2-12H,13-14H2,1H3,(H,25,27)