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

Systemtic Name: ethanedioic acid; [4-[2-(4-ethylpiperazin-1-yl)ethoxy]phenyl]-phenyl-methanone Openeye Name: [4-[2-(4-ethylpiperazin-1-yl)ethoxy]phenyl]-phenyl-methanone; oxalic acid CAS Name: [4-[2-(4-ethyl-1-piperazinyl)ethoxy]phenyl]-phenylmethanone; oxalic acid IUPAC Name: [4-[2-(4-ethylpiperazin-1-yl)ethoxy]phenyl]-phenylmethanone; oxalic acid Traditional Name: [4-[2-(4-ethylpiperazino)ethoxy]phenyl]-phenyl-methanone; oxalic acid Formula: C23H28N2O6 MolecularWeight: 428.47822

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CCOC2=CC=C(C=C2)C(=O)C3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

CCN1CCN(CC1)CCOC2=CC=C(C=C2)C(=O)C3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H26N2O2.C2H2O4/c1-2-22-12-14-23(15-13-22)16-17-25-20-10-8-19(9-11-20)21(24)18-6-4-3-5-7-18;3-1(4)2(5)6/h3-11H,2,12-17H2,1H3;(H,3,4)(H,5,6)