ethanedioic acid; phenyl-(4-propan-2-ylpiperazin-1-yl)methanone

Systemtic Name: ethanedioic acid; phenyl-(4-propan-2-ylpiperazin-1-yl)methanone Openeye Name: (4-isopropylpiperazin-1-yl)-phenyl-methanone; oxalic acid CAS Name: oxalic acid; phenyl-(4-propan-2-yl-1-piperazinyl)methanone IUPAC Name: oxalic acid; phenyl-(4-propan-2-ylpiperazin-1-yl)methanone Traditional Name: (4-isopropylpiperazino)-phenyl-methanone; oxalic acid Formula: C16H22N2O5 MolecularWeight: 322.35628

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O.C2H2O4/c1-12(2)15-8-10-16(11-9-15)14(17)13-6-4-3-5-7-13;3-1(4)2(5)6/h3-7,12H,8-11H2,1-2H3;(H,3,4)(H,5,6)