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

Systemtic Name: ethanedioic acid; 1-[3-[2-(4-ethylpiperazin-1-yl)ethoxy]phenyl]ethanone Openeye Name: 1-[3-[2-(4-ethylpiperazin-1-yl)ethoxy]phenyl]ethanone; oxalic acid CAS Name: 1-[3-[2-(4-ethyl-1-piperazinyl)ethoxy]phenyl]ethanone; oxalic acid IUPAC Name: 1-[3-[2-(4-ethylpiperazin-1-yl)ethoxy]phenyl]ethanone; oxalic acid Traditional Name: 1-[3-[2-(4-ethylpiperazino)ethoxy]phenyl]ethanone; oxalic acid Formula: C18H26N2O6 MolecularWeight: 366.40884

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N2O2.C2H2O4/c1-3-17-7-9-18(10-8-17)11-12-20-16-6-4-5-15(13-16)14(2)19;3-1(4)2(5)6/h4-6,13H,3,7-12H2,1-2H3;(H,3,4)(H,5,6)