ethyl 1-[5-(methoxymethyl)thiophen-2-yl]carbonyl-3-(3-phenylpropyl)piperidine-3-carboxylate

Systemtic Name: ethyl 1-[5-(methoxymethyl)thiophen-2-yl]carbonyl-3-(3-phenylpropyl)piperidine-3-carboxylate Openeye Name: ethyl 1-[5-(methoxymethyl)thiophene-2-carbonyl]-3-(3-phenylpropyl)piperidine-3-carboxylate CAS Name: 1-[[5-(methoxymethyl)-2-thiophenyl]-oxomethyl]-3-(3-phenylpropyl)-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-(methoxymethyl)thiophene-2-carbonyl]-3-(3-phenylpropyl)piperidine-3-carboxylate Traditional Name: 1-[5-(methoxymethyl)thiophene-2-carbonyl]-3-(3-phenylpropyl)nipecotic acid ethyl ester Formula: C24H31NO4S MolecularWeight: 429.57224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)C(=O)C2=CC=C(S2)COC)CCCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1(CCCN(C1)C(=O)C2=CC=C(S2)COC)CCCC3=CC=CC=C3

InChI

InChI=1S/C24H31NO4S/c1-3-29-23(27)24(14-7-11-19-9-5-4-6-10-19)15-8-16-25(18-24)22(26)21-13-12-20(30-21)17-28-2/h4-6,9-10,12-13H,3,7-8,11,14-18H2,1-2H3