(3S)-1-[(E)-3-(2-methylphenyl)prop-2-enoyl]-N-phenyl-piperidine-3-carboxamide

Systemtic Name: (3S)-1-[(E)-3-(2-methylphenyl)prop-2-enoyl]-N-phenyl-piperidine-3-carboxamide Openeye Name: (3S)-1-[(E)-3-(o-tolyl)prop-2-enoyl]-N-phenyl-piperidine-3-carboxamide CAS Name: (3S)-1-[(E)-3-(2-methylphenyl)-1-oxoprop-2-enyl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: (3S)-1-[(E)-3-(2-methylphenyl)prop-2-enoyl]-N-phenylpiperidine-3-carboxamide Traditional Name: (3S)-1-[(E)-3-(o-tolyl)acryloyl]-N-phenyl-nipecotamide Formula: C22H24N2O2 MolecularWeight: 348.43816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C=CC(=O)N2CCCC(C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1/C=C/C(=O)N2CCC[C@@H](C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H24N2O2/c1-17-8-5-6-9-18(17)13-14-21(25)24-15-7-10-19(16-24)22(26)23-20-11-3-2-4-12-20/h2-6,8-9,11-14,19H,7,10,15-16H2,1H3,(H,23,26)/b14-13+/t19-/m0/s1