ethanedioic acid; N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)-2-piperidin-1-yl-ethanamide

Systemtic Name: ethanedioic acid; N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)-2-piperidin-1-yl-ethanamide Openeye Name: N-[4-methoxy-3-(1-piperidylsulfonyl)phenyl]-2-(1-piperidyl)acetamide; oxalic acid CAS Name: N-[4-methoxy-3-(1-piperidinylsulfonyl)phenyl]-2-(1-piperidinyl)acetamide; oxalic acid IUPAC Name: N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-2-piperidin-1-ylacetamide; oxalic acid Traditional Name: N-(4-methoxy-3-piperidinosulfonyl-phenyl)-2-piperidino-acetamide; oxalic acid Formula: C21H31N3O8S MolecularWeight: 485.55114

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CN2CCCCC2)S(=O)(=O)N3CCCCC3.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CN2CCCCC2)S(=O)(=O)N3CCCCC3.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H29N3O4S.C2H2O4/c1-26-17-9-8-16(20-19(23)15-21-10-4-2-5-11-21)14-18(17)27(24,25)22-12-6-3-7-13-22;3-1(4)2(5)6/h8-9,14H,2-7,10-13,15H2,1H3,(H,20,23);(H,3,4)(H,5,6)