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

Systemtic Name: ethanedioic acid; 1-[2-[2-(4-ethylpiperazin-1-yl)ethoxy]phenyl]propan-1-one Openeye Name: 1-[2-[2-(4-ethylpiperazin-1-yl)ethoxy]phenyl]propan-1-one; oxalic acid CAS Name: 1-[2-[2-(4-ethyl-1-piperazinyl)ethoxy]phenyl]-1-propanone; oxalic acid IUPAC Name: 1-[2-[2-(4-ethylpiperazin-1-yl)ethoxy]phenyl]propan-1-one; oxalic acid Traditional Name: 1-[2-[2-(4-ethylpiperazino)ethoxy]phenyl]propan-1-one; oxalic acid Formula: C19H28N2O6 MolecularWeight: 380.43542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=CC=C1OCCN2CCN(CC2)CC.C(=O)(C(=O)O)O

Isomeric SMILES

CCC(=O)C1=CC=CC=C1OCCN2CCN(CC2)CC.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H26N2O2.C2H2O4/c1-3-16(20)15-7-5-6-8-17(15)21-14-13-19-11-9-18(4-2)10-12-19;3-1(4)2(5)6/h5-8H,3-4,9-14H2,1-2H3;(H,3,4)(H,5,6)