ethanedioic acid; [4-[(2-methoxynaphthalen-1-yl)methyl]piperazin-1-yl]-phenyl-methanone

Systemtic Name: ethanedioic acid; [4-[(2-methoxynaphthalen-1-yl)methyl]piperazin-1-yl]-phenyl-methanone Openeye Name: [4-[(2-methoxy-1-naphthyl)methyl]piperazin-1-yl]-phenyl-methanone; oxalic acid CAS Name: [4-[(2-methoxy-1-naphthalenyl)methyl]-1-piperazinyl]-phenylmethanone; oxalic acid IUPAC Name: [4-[(2-methoxynaphthalen-1-yl)methyl]piperazin-1-yl]-phenylmethanone; oxalic acid Traditional Name: [4-[(2-methoxy-1-naphthyl)methyl]piperazino]-phenyl-methanone; oxalic acid Formula: C25H26N2O6 MolecularWeight: 450.48374

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=CC=CC=C2C=C1)CN3CCN(CC3)C(=O)C4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=C(C2=CC=CC=C2C=C1)CN3CCN(CC3)C(=O)C4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C23H24N2O2.C2H2O4/c1-27-22-12-11-18-7-5-6-10-20(18)21(22)17-24-13-15-25(16-14-24)23(26)19-8-3-2-4-9-19;3-1(4)2(5)6/h2-12H,13-17H2,1H3;(H,3,4)(H,5,6)