ethyl 1-[3-[5-oxidanylidene-2-(thiophen-2-ylmethyl)pyrrolidin-2-yl]propanoyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[3-[5-oxidanylidene-2-(thiophen-2-ylmethyl)pyrrolidin-2-yl]propanoyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[3-[5-oxo-2-(2-thienylmethyl)pyrrolidin-2-yl]propanoyl]piperidine-3-carboxylate CAS Name: 1-[1-oxo-3-[5-oxo-2-(thiophen-2-ylmethyl)-2-pyrrolidinyl]propyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[5-oxo-2-(thiophen-2-ylmethyl)pyrrolidin-2-yl]propanoyl]piperidine-3-carboxylate Traditional Name: 1-[3-[5-keto-2-(2-thenyl)pyrrolidin-2-yl]propanoyl]nipecotic acid ethyl ester Formula: C20H28N2O4S MolecularWeight: 392.51232

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)CCC2(CCC(=O)N2)CC3=CC=CS3

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)CCC2(CCC(=O)N2)CC3=CC=CS3

InChI

InChI=1S/C20H28N2O4S/c1-2-26-19(25)15-5-3-11-22(14-15)18(24)8-10-20(9-7-17(23)21-20)13-16-6-4-12-27-16/h4,6,12,15H,2-3,5,7-11,13-14H2,1H3,(H,21,23)