ethyl 1-[(E)-3-phenylsulfanylprop-2-enoyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[(E)-3-phenylsulfanylprop-2-enoyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[(E)-3-phenylsulfanylprop-2-enoyl]piperidine-3-carboxylate CAS Name: 1-[(E)-1-oxo-3-(phenylthio)prop-2-enyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(E)-3-phenylsulfanylprop-2-enoyl]piperidine-3-carboxylate Traditional Name: 1-[(E)-3-(phenylthio)acryloyl]nipecotic acid ethyl ester Formula: C17H21NO3S MolecularWeight: 319.41854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C=CSC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)/C=C/SC2=CC=CC=C2

InChI

InChI=1S/C17H21NO3S/c1-2-21-17(20)14-7-6-11-18(13-14)16(19)10-12-22-15-8-4-3-5-9-15/h3-5,8-10,12,14H,2,6-7,11,13H2,1H3/b12-10+