ethanedioic acid; 1-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]-4-(2-methoxyphenyl)piperazine

Systemtic Name: ethanedioic acid; 1-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]-4-(2-methoxyphenyl)piperazine Openeye Name: 1-[1-(4-fluorophenyl)sulfonyl-4-piperidyl]-4-(2-methoxyphenyl)piperazine; oxalic acid CAS Name: 1-[1-(4-fluorophenyl)sulfonyl-4-piperidinyl]-4-(2-methoxyphenyl)piperazine; oxalic acid IUPAC Name: 1-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]-4-(2-methoxyphenyl)piperazine; oxalic acid Traditional Name: 1-[1-(4-fluorophenyl)sulfonyl-4-piperidyl]-4-(2-methoxyphenyl)piperazine; oxalic acid Formula: C24H30FN3O7S MolecularWeight: 523.574303

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)F.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)F.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H28FN3O3S.C2H2O4/c1-29-22-5-3-2-4-21(22)25-16-14-24(15-17-25)19-10-12-26(13-11-19)30(27,28)20-8-6-18(23)7-9-20;3-1(4)2(5)6/h2-9,19H,10-17H2,1H3;(H,3,4)(H,5,6)