ethanedioic acid; 3-imidazol-1-yl-N-(pyridin-3-ylmethyl)propan-1-amine

Systemtic Name: ethanedioic acid; 3-imidazol-1-yl-N-(pyridin-3-ylmethyl)propan-1-amine Openeye Name: 3-imidazol-1-yl-N-(3-pyridylmethyl)propan-1-amine; oxalic acid CAS Name: 3-(1-imidazolyl)-N-(3-pyridinylmethyl)-1-propanamine; oxalic acid IUPAC Name: 3-imidazol-1-yl-N-(pyridin-3-ylmethyl)propan-1-amine; oxalic acid Traditional Name: 3-imidazol-1-ylpropyl(3-pyridylmethyl)amine; oxalic acid Formula: C14H18N4O4 MolecularWeight: 306.31712

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNCCCN2C=CN=C2.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CC(=CN=C1)CNCCCN2C=CN=C2.C(=O)(C(=O)O)O

InChI

InChI=1S/C12H16N4.C2H2O4/c1-3-12(9-13-4-1)10-14-5-2-7-16-8-6-15-11-16;3-1(4)2(5)6/h1,3-4,6,8-9,11,14H,2,5,7,10H2;(H,3,4)(H,5,6)