ethanedioic acid; 3-methyl-1-[1-(phenylsulfonyl)piperidin-4-yl]piperidine

Systemtic Name: ethanedioic acid; 3-methyl-1-[1-(phenylsulfonyl)piperidin-4-yl]piperidine Openeye Name: 1-[1-(benzenesulfonyl)-4-piperidyl]-3-methyl-piperidine; oxalic acid CAS Name: 1-[1-(benzenesulfonyl)-4-piperidinyl]-3-methylpiperidine; oxalic acid IUPAC Name: 1-[1-(benzenesulfonyl)piperidin-4-yl]-3-methylpiperidine; oxalic acid Traditional Name: 1-(1-besyl-4-piperidyl)-3-methyl-piperidine; oxalic acid Formula: C19H28N2O6S MolecularWeight: 412.50042

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

CC1CCCN(C1)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H26N2O2S.C2H2O4/c1-15-6-5-11-18(14-15)16-9-12-19(13-10-16)22(20,21)17-7-3-2-4-8-17;3-1(4)2(5)6/h2-4,7-8,15-16H,5-6,9-14H2,1H3;(H,3,4)(H,5,6)