ethanedioic acid; N2-(3-piperidin-1-ylpropyl)pyridine-2,5-diamine

Systemtic Name: ethanedioic acid; N2-(3-piperidin-1-ylpropyl)pyridine-2,5-diamine Openeye Name: oxalic acid; N2-[3-(1-piperidyl)propyl]pyridine-2,5-diamine CAS Name: oxalic acid; N2-[3-(1-piperidinyl)propyl]pyridine-2,5-diamine IUPAC Name: oxalic acid; 2-N-(3-piperidin-1-ylpropyl)pyridine-2,5-diamine Traditional Name: (5-amino-2-pyridyl)-(3-piperidinopropyl)amine; oxalic acid Formula: C19H28N4O12 MolecularWeight: 504.44522

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCNC2=NC=C(C=C2)N.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCN(CC1)CCCNC2=NC=C(C=C2)N.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C13H22N4.3C2H2O4/c14-12-5-6-13(16-11-12)15-7-4-10-17-8-2-1-3-9-17;3*3-1(4)2(5)6/h5-6,11H,1-4,7-10,14H2,(H,15,16);3*(H,3,4)(H,5,6)