ethanedioic acid; 1-(4-methoxyphenyl)sulfonyl-4-piperidin-1-yl-piperidine

Systemtic Name: ethanedioic acid; 1-(4-methoxyphenyl)sulfonyl-4-piperidin-1-yl-piperidine Openeye Name: 1-(4-methoxyphenyl)sulfonyl-4-(1-piperidyl)piperidine; oxalic acid CAS Name: 1-(4-methoxyphenyl)sulfonyl-4-(1-piperidinyl)piperidine; oxalic acid IUPAC Name: 1-(4-methoxyphenyl)sulfonyl-4-piperidin-1-ylpiperidine; oxalic acid Traditional Name: 1-(4-methoxyphenyl)sulfonyl-4-piperidino-piperidine; oxalic acid Formula: C19H28N2O7S MolecularWeight: 428.49982

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)N3CCCCC3.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)N3CCCCC3.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H26N2O3S.C2H2O4/c1-22-16-5-7-17(8-6-16)23(20,21)19-13-9-15(10-14-19)18-11-3-2-4-12-18;3-1(4)2(5)6/h5-8,15H,2-4,9-14H2,1H3;(H,3,4)(H,5,6)