ethanedioic acid; [4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]-phenyl-methanone

Systemtic Name: ethanedioic acid; [4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]-phenyl-methanone Openeye Name: [4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]-phenyl-methanone; oxalic acid CAS Name: [4-[2-(4-methyl-1-piperazinyl)ethoxy]phenyl]-phenylmethanone; oxalic acid IUPAC Name: [4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]-phenylmethanone; oxalic acid Traditional Name: [4-[2-(4-methylpiperazino)ethoxy]phenyl]-phenyl-methanone; oxalic acid Formula: C22H26N2O6 MolecularWeight: 414.45164

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCOC2=CC=C(C=C2)C(=O)C3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

CN1CCN(CC1)CCOC2=CC=C(C=C2)C(=O)C3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H24N2O2.C2H2O4/c1-21-11-13-22(14-12-21)15-16-24-19-9-7-18(8-10-19)20(23)17-5-3-2-4-6-17;3-1(4)2(5)6/h2-10H,11-16H2,1H3;(H,3,4)(H,5,6)