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

Systemtic Name: [2-oxidanylidene-2-[(2-propan-2-ylphenyl)amino]ethyl] (E)-3-(4-bromophenyl)prop-2-enoate Openeye Name: [2-(2-isopropylanilino)-2-oxo-ethyl] (E)-3-(4-bromophenyl)prop-2-enoate CAS Name: (E)-3-(4-bromophenyl)-2-propenoic acid [2-oxo-2-(2-propan-2-ylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(2-propan-2-ylanilino)ethyl] (E)-3-(4-bromophenyl)prop-2-enoate Traditional Name: (E)-3-(4-bromophenyl)acrylic acid [2-(2-isopropylanilino)-2-keto-ethyl] ester Formula: C20H20BrNO3 MolecularWeight: 402.2817

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC(=O)COC(=O)C=CC2=CC=C(C=C2)Br

Isomeric SMILES

CC(C)C1=CC=CC=C1NC(=O)COC(=O)/C=C/C2=CC=C(C=C2)Br

InChI

InChI=1S/C20H20BrNO3/c1-14(2)17-5-3-4-6-18(17)22-19(23)13-25-20(24)12-9-15-7-10-16(21)11-8-15/h3-12,14H,13H2,1-2H3,(H,22,23)/b12-9+