[2-[(4-bromanyl-3-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 3-(4-chlorophenyl)-2-cyano-prop-2-enoate

Systemtic Name: [2-[(4-bromanyl-3-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 3-(4-chlorophenyl)-2-cyano-prop-2-enoate Openeye Name: [2-(4-bromo-3-methyl-anilino)-2-oxo-ethyl] 3-(4-chlorophenyl)-2-cyano-prop-2-enoate CAS Name: 3-(4-chlorophenyl)-2-cyano-2-propenoic acid [2-(4-bromo-3-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromo-3-methylanilino)-2-oxoethyl] 3-(4-chlorophenyl)-2-cyanoprop-2-enoate Traditional Name: 3-(4-chlorophenyl)-2-cyano-acrylic acid [2-(4-bromo-3-methyl-anilino)-2-keto-ethyl] ester Formula: C19H14BrClN2O3 MolecularWeight: 433.68306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)COC(=O)C(=CC2=CC=C(C=C2)Cl)C#N)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)COC(=O)C(=CC2=CC=C(C=C2)Cl)C#N)Br

InChI

InChI=1S/C19H14BrClN2O3/c1-12-8-16(6-7-17(12)20)23-18(24)11-26-19(25)14(10-22)9-13-2-4-15(21)5-3-13/h2-9H,11H2,1H3,(H,23,24)