methyl 1-[(E)-3-(3-bromophenyl)prop-2-enoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[(E)-3-(3-bromophenyl)prop-2-enoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[(E)-3-(3-bromophenyl)prop-2-enoyl]piperidine-4-carboxylate CAS Name: 1-[(E)-3-(3-bromophenyl)-1-oxoprop-2-enyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[(E)-3-(3-bromophenyl)prop-2-enoyl]piperidine-4-carboxylate Traditional Name: 1-[(E)-3-(3-bromophenyl)acryloyl]isonipecotic acid methyl ester Formula: C16H18BrNO3 MolecularWeight: 352.22302

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)C=CC2=CC(=CC=C2)Br

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)/C=C/C2=CC(=CC=C2)Br

InChI

InChI=1S/C16H18BrNO3/c1-21-16(20)13-7-9-18(10-8-13)15(19)6-5-12-3-2-4-14(17)11-12/h2-6,11,13H,7-10H2,1H3/b6-5+