[2-[(3-bromophenyl)amino]-2-oxidanylidene-ethyl] 2-cyano-3-phenyl-prop-2-enoate

Systemtic Name: [2-[(3-bromophenyl)amino]-2-oxidanylidene-ethyl] 2-cyano-3-phenyl-prop-2-enoate Openeye Name: [2-(3-bromoanilino)-2-oxo-ethyl] 2-cyano-3-phenyl-prop-2-enoate CAS Name: 2-cyano-3-phenyl-2-propenoic acid [2-(3-bromoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-bromoanilino)-2-oxoethyl] 2-cyano-3-phenylprop-2-enoate Traditional Name: 2-cyano-3-phenyl-acrylic acid [2-(3-bromoanilino)-2-keto-ethyl] ester Formula: C18H13BrN2O3 MolecularWeight: 385.21142

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=C(C#N)C(=O)OCC(=O)NC2=CC(=CC=C2)Br

Isomeric SMILES

C1=CC=C(C=C1)C=C(C#N)C(=O)OCC(=O)NC2=CC(=CC=C2)Br

InChI

InChI=1S/C18H13BrN2O3/c19-15-7-4-8-16(10-15)21-17(22)12-24-18(23)14(11-20)9-13-5-2-1-3-6-13/h1-10H,12H2,(H,21,22)