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

Systemtic Name: 1-(2-butyl-4-phenyl-piperazin-1-yl)propan-2-amine; ethanedioic acid Openeye Name: 1-(2-butyl-4-phenyl-piperazin-1-yl)propan-2-amine; oxalic acid CAS Name: 1-(2-butyl-4-phenyl-1-piperazinyl)-2-propanamine; oxalic acid IUPAC Name: 1-(2-butyl-4-phenylpiperazin-1-yl)propan-2-amine; oxalic acid Traditional Name: [2-(2-butyl-4-phenyl-piperazino)-1-methyl-ethyl]amine; oxalic acid Formula: C21H33N3O8 MolecularWeight: 455.50202

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CN(CCN1CC(C)N)C2=CC=CC=C2.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCC1CN(CCN1CC(C)N)C2=CC=CC=C2.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H29N3.2C2H2O4/c1-3-4-8-17-14-20(16-9-6-5-7-10-16)12-11-19(17)13-15(2)18;2*3-1(4)2(5)6/h5-7,9-10,15,17H,3-4,8,11-14,18H2,1-2H3;2*(H,3,4)(H,5,6)