ethyl 4-[phenyl(propanoyl)amino]-1-(2-thiophen-2-ylethyl)piperidine-4-carboxylate hydrochloride

Systemtic Name: ethyl 4-[phenyl(propanoyl)amino]-1-(2-thiophen-2-ylethyl)piperidine-4-carboxylate hydrochloride Openeye Name: ethyl 4-(N-propanoylanilino)-1-[2-(2-thienyl)ethyl]piperidine-4-carboxylate hydrochloride CAS Name: 4-[N-(1-oxopropyl)anilino]-1-(2-thiophen-2-ylethyl)-4-piperidinecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 4-(N-propanoylanilino)-1-(2-thiophen-2-ylethyl)piperidine-4-carboxylate hydrochloride Traditional Name: 4-(N-propionylanilino)-1-[2-(2-thienyl)ethyl]isonipecotic acid ethyl ester hydrochloride Formula: C23H31ClN2O3S MolecularWeight: 451.02184

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1=CC=CC=C1)C2(CCN(CC2)CCC3=CC=CS3)C(=O)OCC.Cl

Isomeric SMILES

CCC(=O)N(C1=CC=CC=C1)C2(CCN(CC2)CCC3=CC=CS3)C(=O)OCC.Cl

InChI

InChI=1S/C23H30N2O3S.ClH/c1-3-21(26)25(19-9-6-5-7-10-19)23(22(27)28-4-2)13-16-24(17-14-23)15-12-20-11-8-18-29-20;/h5-11,18H,3-4,12-17H2,1-2H3;1H