diphenyl-[4-[(3,4,5-trimethoxyphenyl)methyl]piperazin-1-yl]methanol; ethanedioic acid

Systemtic Name: diphenyl-[4-[(3,4,5-trimethoxyphenyl)methyl]piperazin-1-yl]methanol; ethanedioic acid Openeye Name: diphenyl-[4-[(3,4,5-trimethoxyphenyl)methyl]piperazin-1-yl]methanol; oxalic acid CAS Name: diphenyl-[4-[(3,4,5-trimethoxyphenyl)methyl]-1-piperazinyl]methanol; oxalic acid IUPAC Name: diphenyl-[4-[(3,4,5-trimethoxyphenyl)methyl]piperazin-1-yl]methanol; oxalic acid Traditional Name: diphenyl-[4-(3,4,5-trimethoxybenzyl)piperazino]methanol; oxalic acid Formula: C29H34N2O8 MolecularWeight: 538.58886

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CN2CCN(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CN2CCN(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C27H32N2O4.C2H2O4/c1-31-24-18-21(19-25(32-2)26(24)33-3)20-28-14-16-29(17-15-28)27(30,22-10-6-4-7-11-22)23-12-8-5-9-13-23;3-1(4)2(5)6/h4-13,18-19,30H,14-17,20H2,1-3H3;(H,3,4)(H,5,6)