ethanedioic acid; 2-phenoxy-1-(4-propan-2-ylpiperazin-1-yl)ethanone

Systemtic Name: ethanedioic acid; 2-phenoxy-1-(4-propan-2-ylpiperazin-1-yl)ethanone Openeye Name: 1-(4-isopropylpiperazin-1-yl)-2-phenoxy-ethanone; oxalic acid CAS Name: oxalic acid; 2-phenoxy-1-(4-propan-2-yl-1-piperazinyl)ethanone IUPAC Name: oxalic acid; 2-phenoxy-1-(4-propan-2-ylpiperazin-1-yl)ethanone Traditional Name: 1-(4-isopropylpiperazino)-2-phenoxy-ethanone; oxalic acid Formula: C17H24N2O6 MolecularWeight: 352.38226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)C(=O)COC2=CC=CC=C2.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)N1CCN(CC1)C(=O)COC2=CC=CC=C2.C(=O)(C(=O)O)O

InChI

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