ethanedioic acid; 1-[3-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]ethanone

Systemtic Name: ethanedioic acid; 1-[3-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]ethanone Openeye Name: 1-[3-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]ethanone; oxalic acid CAS Name: 1-[3-[2-(4-methyl-1-piperazinyl)ethoxy]phenyl]ethanone; oxalic acid IUPAC Name: 1-[3-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]ethanone; oxalic acid Traditional Name: 1-[3-[2-(4-methylpiperazino)ethoxy]phenyl]ethanone; oxalic acid Formula: C17H24N2O6 MolecularWeight: 352.38226

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)OCCN2CCN(CC2)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)OCCN2CCN(CC2)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H22N2O2.C2H2O4/c1-13(18)14-4-3-5-15(12-14)19-11-10-17-8-6-16(2)7-9-17;3-1(4)2(5)6/h3-5,12H,6-11H2,1-2H3;(H,3,4)(H,5,6)