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

Systemtic Name: N-[(2-chlorophenyl)methyl]-1-[(3-methylthiophen-2-yl)methyl]piperidine-4-carboxamide; ethanedioic acid Openeye Name: N-[(2-chlorophenyl)methyl]-1-[(3-methyl-2-thienyl)methyl]piperidine-4-carboxamide; oxalic acid CAS Name: N-[(2-chlorophenyl)methyl]-1-[(3-methyl-2-thiophenyl)methyl]-4-piperidinecarboxamide; oxalic acid IUPAC Name: N-[(2-chlorophenyl)methyl]-1-[(3-methylthiophen-2-yl)methyl]piperidine-4-carboxamide; oxalic acid Traditional Name: N-(2-chlorobenzyl)-1-[(3-methyl-2-thienyl)methyl]isonipecotamide; oxalic acid Formula: C21H25ClN2O5S MolecularWeight: 452.9516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CN2CCC(CC2)C(=O)NCC3=CC=CC=C3Cl.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(SC=C1)CN2CCC(CC2)C(=O)NCC3=CC=CC=C3Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H23ClN2OS.C2H2O4/c1-14-8-11-24-18(14)13-22-9-6-15(7-10-22)19(23)21-12-16-4-2-3-5-17(16)20;3-1(4)2(5)6/h2-5,8,11,15H,6-7,9-10,12-13H2,1H3,(H,21,23);(H,3,4)(H,5,6)