ethyl 1-(5-ethanoylthiophen-2-yl)carbonyl-3-phenethyl-piperidine-3-carboxylate

Systemtic Name: ethyl 1-(5-ethanoylthiophen-2-yl)carbonyl-3-phenethyl-piperidine-3-carboxylate Openeye Name: ethyl 1-(5-acetylthiophene-2-carbonyl)-3-phenethyl-piperidine-3-carboxylate CAS Name: 1-[(5-acetyl-2-thiophenyl)-oxomethyl]-3-phenethyl-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(5-acetylthiophene-2-carbonyl)-3-phenethylpiperidine-3-carboxylate Traditional Name: 1-(5-acetylthiophene-2-carbonyl)-3-phenethyl-nipecotic acid ethyl ester Formula: C23H27NO4S MolecularWeight: 413.52978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)C(=O)C2=CC=C(S2)C(=O)C)CCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1(CCCN(C1)C(=O)C2=CC=C(S2)C(=O)C)CCC3=CC=CC=C3

InChI

InChI=1S/C23H27NO4S/c1-3-28-22(27)23(14-12-18-8-5-4-6-9-18)13-7-15-24(16-23)21(26)20-11-10-19(29-20)17(2)25/h4-6,8-11H,3,7,12-16H2,1-2H3