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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20BrNO3/c21-18-11-8-17(9-12-18)10-13-20(24)25-15-19(23)22-14-4-7-16-5-2-1-3-6-16/h1-3,5-6,8-13H,4,7,14-15H2,(H,22,23)/b13-10+