ethanedioic acid; (4-methoxyphenyl)-[4-[4-(2-methoxyphenyl)piperazin-1-yl]piperidin-1-yl]methanone

Systemtic Name: ethanedioic acid; (4-methoxyphenyl)-[4-[4-(2-methoxyphenyl)piperazin-1-yl]piperidin-1-yl]methanone Openeye Name: (4-methoxyphenyl)-[4-[4-(2-methoxyphenyl)piperazin-1-yl]-1-piperidyl]methanone; oxalic acid CAS Name: (4-methoxyphenyl)-[4-[4-(2-methoxyphenyl)-1-piperazinyl]-1-piperidinyl]methanone; oxalic acid IUPAC Name: (4-methoxyphenyl)-[4-[4-(2-methoxyphenyl)piperazin-1-yl]piperidin-1-yl]methanone; oxalic acid Traditional Name: (4-methoxyphenyl)-[4-[4-(2-methoxyphenyl)piperazino]piperidino]methanone; oxalic acid Formula: C26H33N3O7 MolecularWeight: 499.55612

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N2CCC(CC2)N3CCN(CC3)C4=CC=CC=C4OC.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N2CCC(CC2)N3CCN(CC3)C4=CC=CC=C4OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C24H31N3O3.C2H2O4/c1-29-21-9-7-19(8-10-21)24(28)27-13-11-20(12-14-27)25-15-17-26(18-16-25)22-5-3-4-6-23(22)30-2;3-1(4)2(5)6/h3-10,20H,11-18H2,1-2H3;(H,3,4)(H,5,6)