ethyl 1-[5-(methoxymethyl)thiophen-2-yl]carbonyl-4-(3-phenylpropyl)piperidine-4-carboxylate

Systemtic Name: ethyl 1-[5-(methoxymethyl)thiophen-2-yl]carbonyl-4-(3-phenylpropyl)piperidine-4-carboxylate Openeye Name: ethyl 1-[5-(methoxymethyl)thiophene-2-carbonyl]-4-(3-phenylpropyl)piperidine-4-carboxylate CAS Name: 1-[[5-(methoxymethyl)-2-thiophenyl]-oxomethyl]-4-(3-phenylpropyl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-(methoxymethyl)thiophene-2-carbonyl]-4-(3-phenylpropyl)piperidine-4-carboxylate Traditional Name: 1-[5-(methoxymethyl)thiophene-2-carbonyl]-4-(3-phenylpropyl)isonipecotic acid ethyl ester Formula: C24H31NO4S MolecularWeight: 429.57224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)C(=O)C2=CC=C(S2)COC)CCCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C(=O)C2=CC=C(S2)COC)CCCC3=CC=CC=C3

InChI

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