1-[3-[4-(diphenylmethyl)piperazin-1-yl]propyl]piperidin-2-one; ethanedioic acid

Systemtic Name: 1-[3-[4-(diphenylmethyl)piperazin-1-yl]propyl]piperidin-2-one; ethanedioic acid Openeye Name: 1-[3-(4-benzhydrylpiperazin-1-yl)propyl]piperidin-2-one; oxalic acid CAS Name: 1-[3-[4-(diphenylmethyl)-1-piperazinyl]propyl]-2-piperidinone; oxalic acid IUPAC Name: 1-[3-(4-benzhydrylpiperazin-1-yl)propyl]piperidin-2-one; oxalic acid Traditional Name: 1-[3-(4-benzhydrylpiperazino)propyl]-2-piperidone; oxalic acid Formula: C27H35N3O5 MolecularWeight: 481.5839

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(=O)C1)CCCN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCN(C(=O)C1)CCCN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C25H33N3O.C2H2O4/c29-24-14-7-8-16-27(24)17-9-15-26-18-20-28(21-19-26)25(22-10-3-1-4-11-22)23-12-5-2-6-13-23;3-1(4)2(5)6/h1-6,10-13,25H,7-9,14-21H2;(H,3,4)(H,5,6)