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

Systemtic Name: ethanedioic acid; 4-methyl-1-(1-naphthalen-2-ylsulfonylpiperidin-4-yl)piperidine Openeye Name: 4-methyl-1-[1-(2-naphthylsulfonyl)-4-piperidyl]piperidine; oxalic acid CAS Name: 4-methyl-1-[1-(2-naphthalenylsulfonyl)-4-piperidinyl]piperidine; oxalic acid IUPAC Name: 4-methyl-1-(1-naphthalen-2-ylsulfonylpiperidin-4-yl)piperidine; oxalic acid Traditional Name: 4-methyl-1-[1-(2-naphthylsulfonyl)-4-piperidyl]piperidine; oxalic acid Formula: C23H30N2O6S MolecularWeight: 462.5591

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3.C(=O)(C(=O)O)O

Isomeric SMILES

CC1CCN(CC1)C2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3.C(=O)(C(=O)O)O

InChI

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