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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)N3CCN(CC3)C4=CC=CC=C4F.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)N3CCN(CC3)C4=CC=CC=C4F.C(=O)(C(=O)O)O

InChI

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