ethanedioic acid; 1-(4-phenyl-2-propan-2-yl-piperazin-1-yl)propan-2-amine

Systemtic Name: ethanedioic acid; 1-(4-phenyl-2-propan-2-yl-piperazin-1-yl)propan-2-amine Openeye Name: 1-(2-isopropyl-4-phenyl-piperazin-1-yl)propan-2-amine; oxalic acid CAS Name: oxalic acid; 1-(4-phenyl-2-propan-2-yl-1-piperazinyl)-2-propanamine IUPAC Name: oxalic acid; 1-(4-phenyl-2-propan-2-ylpiperazin-1-yl)propan-2-amine Traditional Name: [2-(2-isopropyl-4-phenyl-piperazino)-1-methyl-ethyl]amine; oxalic acid Formula: C20H31N3O8 MolecularWeight: 441.47544

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1CN(CCN1CC(C)N)C2=CC=CC=C2.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)C1CN(CCN1CC(C)N)C2=CC=CC=C2.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H27N3.2C2H2O4/c1-13(2)16-12-18(15-7-5-4-6-8-15)9-10-19(16)11-14(3)17;2*3-1(4)2(5)6/h4-8,13-14,16H,9-12,17H2,1-3H3;2*(H,3,4)(H,5,6)