ethanedioic acid; 1-methyl-4-(1-naphthalen-2-ylsulfonylpiperidin-4-yl)piperazine

Systemtic Name: ethanedioic acid; 1-methyl-4-(1-naphthalen-2-ylsulfonylpiperidin-4-yl)piperazine Openeye Name: 1-methyl-4-[1-(2-naphthylsulfonyl)-4-piperidyl]piperazine; oxalic acid CAS Name: 1-methyl-4-[1-(2-naphthalenylsulfonyl)-4-piperidinyl]piperazine; oxalic acid IUPAC Name: 1-methyl-4-(1-naphthalen-2-ylsulfonylpiperidin-4-yl)piperazine; oxalic acid Traditional Name: 1-methyl-4-[1-(2-naphthylsulfonyl)-4-piperidyl]piperazine; oxalic acid Formula: C22H29N3O6S MolecularWeight: 463.54716

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3.C(=O)(C(=O)O)O

Isomeric SMILES

CN1CCN(CC1)C2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H27N3O2S.C2H2O4/c1-21-12-14-22(15-13-21)19-8-10-23(11-9-19)26(24,25)20-7-6-17-4-2-3-5-18(17)16-20;3-1(4)2(5)6/h2-7,16,19H,8-15H2,1H3;(H,3,4)(H,5,6)