ethanedioic acid; N-(2-hydroxyethyl)-1-[(3-methylthiophen-2-yl)methyl]-N-(phenylmethyl)piperidine-4-carboxamide

Systemtic Name: ethanedioic acid; N-(2-hydroxyethyl)-1-[(3-methylthiophen-2-yl)methyl]-N-(phenylmethyl)piperidine-4-carboxamide Openeye Name: N-benzyl-N-(2-hydroxyethyl)-1-[(3-methyl-2-thienyl)methyl]piperidine-4-carboxamide; oxalic acid CAS Name: N-(2-hydroxyethyl)-1-[(3-methyl-2-thiophenyl)methyl]-N-(phenylmethyl)-4-piperidinecarboxamide; oxalic acid IUPAC Name: N-benzyl-N-(2-hydroxyethyl)-1-[(3-methylthiophen-2-yl)methyl]piperidine-4-carboxamide; oxalic acid Traditional Name: N-benzyl-N-(2-hydroxyethyl)-1-[(3-methyl-2-thienyl)methyl]isonipecotamide; oxalic acid Formula: C23H30N2O6S MolecularWeight: 462.5591

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CN2CCC(CC2)C(=O)N(CCO)CC3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(SC=C1)CN2CCC(CC2)C(=O)N(CCO)CC3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H28N2O2S.C2H2O4/c1-17-9-14-26-20(17)16-22-10-7-19(8-11-22)21(25)23(12-13-24)15-18-5-3-2-4-6-18;3-1(4)2(5)6/h2-6,9,14,19,24H,7-8,10-13,15-16H2,1H3;(H,3,4)(H,5,6)