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

Systemtic Name: ethanedioic acid; [4-(naphthalen-1-ylmethyl)piperazin-1-yl]-phenyl-methanone Openeye Name: [4-(1-naphthylmethyl)piperazin-1-yl]-phenyl-methanone; oxalic acid CAS Name: [4-(1-naphthalenylmethyl)-1-piperazinyl]-phenylmethanone; oxalic acid IUPAC Name: [4-(naphthalen-1-ylmethyl)piperazin-1-yl]-phenylmethanone; oxalic acid Traditional Name: [4-(1-naphthylmethyl)piperazino]-phenyl-methanone; oxalic acid Formula: C24H24N2O5 MolecularWeight: 420.45776

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22N2O.C2H2O4/c25-22(19-8-2-1-3-9-19)24-15-13-23(14-16-24)17-20-11-6-10-18-7-4-5-12-21(18)20;3-1(4)2(5)6/h1-12H,13-17H2;(H,3,4)(H,5,6)