[2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl] (E)-3-(4-cyanophenyl)prop-2-enoate

Systemtic Name: [2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl] (E)-3-(4-cyanophenyl)prop-2-enoate Openeye Name: [2-(4-bromoanilino)-2-oxo-ethyl] (E)-3-(4-cyanophenyl)prop-2-enoate CAS Name: (E)-3-(4-cyanophenyl)-2-propenoic acid [2-(4-bromoanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromoanilino)-2-oxoethyl] (E)-3-(4-cyanophenyl)prop-2-enoate Traditional Name: (E)-3-(4-cyanophenyl)acrylic acid [2-(4-bromoanilino)-2-keto-ethyl] ester Formula: C18H13BrN2O3 MolecularWeight: 385.21142

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC(=O)OCC(=O)NC2=CC=C(C=C2)Br)C#N

Isomeric SMILES

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

InChI

InChI=1S/C18H13BrN2O3/c19-15-6-8-16(9-7-15)21-17(22)12-24-18(23)10-5-13-1-3-14(11-20)4-2-13/h1-10H,12H2,(H,21,22)/b10-5+