ethanedioic acid; 1-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]-2-phenyl-ethanone

Systemtic Name: ethanedioic acid; 1-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]-2-phenyl-ethanone Openeye Name: 1-[4-(1-naphthylmethyl)piperazin-1-yl]-2-phenyl-ethanone; oxalic acid CAS Name: 1-[4-(1-naphthalenylmethyl)-1-piperazinyl]-2-phenylethanone; oxalic acid IUPAC Name: 1-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]-2-phenylethanone; oxalic acid Traditional Name: 1-[4-(1-naphthylmethyl)piperazino]-2-phenyl-ethanone; oxalic acid Formula: C25H26N2O5 MolecularWeight: 434.48434

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC3=CC=CC=C32)C(=O)CC4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCN1CC2=CC=CC3=CC=CC=C32)C(=O)CC4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C23H24N2O.C2H2O4/c26-23(17-19-7-2-1-3-8-19)25-15-13-24(14-16-25)18-21-11-6-10-20-9-4-5-12-22(20)21;3-1(4)2(5)6/h1-12H,13-18H2;(H,3,4)(H,5,6)