(3S)-1-[(E)-3-(4-ethoxyphenyl)prop-2-enoyl]-N-phenyl-piperidine-3-carboxamide

Systemtic Name: (3S)-1-[(E)-3-(4-ethoxyphenyl)prop-2-enoyl]-N-phenyl-piperidine-3-carboxamide Openeye Name: (3S)-1-[(E)-3-(4-ethoxyphenyl)prop-2-enoyl]-N-phenyl-piperidine-3-carboxamide CAS Name: (3S)-1-[(E)-3-(4-ethoxyphenyl)-1-oxoprop-2-enyl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: (3S)-1-[(E)-3-(4-ethoxyphenyl)prop-2-enoyl]-N-phenylpiperidine-3-carboxamide Traditional Name: (3S)-N-phenyl-1-[(E)-3-p-phenetylacryloyl]nipecotamide Formula: C23H26N2O3 MolecularWeight: 378.46414

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=CC(=O)N2CCCC(C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)/C=C/C(=O)N2CCC[C@@H](C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C23H26N2O3/c1-2-28-21-13-10-18(11-14-21)12-15-22(26)25-16-6-7-19(17-25)23(27)24-20-8-4-3-5-9-20/h3-5,8-15,19H,2,6-7,16-17H2,1H3,(H,24,27)/b15-12+/t19-/m0/s1