2,2-diphenyl-1-[4-[1-(phenylmethyl)piperidin-4-yl]piperazin-1-yl]ethanone; ethanedioic acid

Systemtic Name: 2,2-diphenyl-1-[4-[1-(phenylmethyl)piperidin-4-yl]piperazin-1-yl]ethanone; ethanedioic acid Openeye Name: 1-[4-(1-benzyl-4-piperidyl)piperazin-1-yl]-2,2-diphenyl-ethanone; oxalic acid CAS Name: 2,2-diphenyl-1-[4-[1-(phenylmethyl)-4-piperidinyl]-1-piperazinyl]ethanone; oxalic acid IUPAC Name: 1-[4-(1-benzylpiperidin-4-yl)piperazin-1-yl]-2,2-diphenylethanone; oxalic acid Traditional Name: 1-[4-(1-benzyl-4-piperidyl)piperazino]-2,2-diphenyl-ethanone; oxalic acid Formula: C32H37N3O5 MolecularWeight: 543.65328

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2CCN(CC2)C(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)CC5=CC=CC=C5.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCC1N2CCN(CC2)C(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)CC5=CC=CC=C5.C(=O)(C(=O)O)O

InChI

InChI=1S/C30H35N3O.C2H2O4/c34-30(29(26-12-6-2-7-13-26)27-14-8-3-9-15-27)33-22-20-32(21-23-33)28-16-18-31(19-17-28)24-25-10-4-1-5-11-25;3-1(4)2(5)6/h1-15,28-29H,16-24H2;(H,3,4)(H,5,6)