(3S)-1-[(E)-3-(2-methoxy-5-methyl-phenyl)prop-2-enoyl]-N-phenyl-piperidine-3-carboxamide

Systemtic Name: (3S)-1-[(E)-3-(2-methoxy-5-methyl-phenyl)prop-2-enoyl]-N-phenyl-piperidine-3-carboxamide Openeye Name: (3S)-1-[(E)-3-(2-methoxy-5-methyl-phenyl)prop-2-enoyl]-N-phenyl-piperidine-3-carboxamide CAS Name: (3S)-1-[(E)-3-(2-methoxy-5-methylphenyl)-1-oxoprop-2-enyl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: (3S)-1-[(E)-3-(2-methoxy-5-methylphenyl)prop-2-enoyl]-N-phenylpiperidine-3-carboxamide Traditional Name: (3S)-1-[(E)-3-(2-methoxy-5-methyl-phenyl)acryloyl]-N-phenyl-nipecotamide Formula: C23H26N2O3 MolecularWeight: 378.46414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C=CC(=O)N2CCCC(C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C23H26N2O3/c1-17-10-12-21(28-2)18(15-17)11-13-22(26)25-14-6-7-19(16-25)23(27)24-20-8-4-3-5-9-20/h3-5,8-13,15,19H,6-7,14,16H2,1-2H3,(H,24,27)/b13-11+/t19-/m0/s1