ethanedioic acid; 2-heptan-4-yl-3H-imidazo[4,5-c]pyridine

Systemtic Name: ethanedioic acid; 2-heptan-4-yl-3H-imidazo[4,5-c]pyridine Openeye Name: oxalic acid; 2-(1-propylbutyl)-3H-imidazo[4,5-c]pyridine CAS Name: 2-heptan-4-yl-3H-imidazo[4,5-c]pyridine; oxalic acid IUPAC Name: 2-heptan-4-yl-3H-imidazo[4,5-c]pyridine; oxalic acid Traditional Name: oxalic acid; 2-(1-propylbutyl)-3H-imidazo[4,5-c]pyridine Formula: C15H21N3O4 MolecularWeight: 307.34494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C1=NC2=C(N1)C=NC=C2.C(=O)(C(=O)O)O

Isomeric SMILES

CCCC(CCC)C1=NC2=C(N1)C=NC=C2.C(=O)(C(=O)O)O

InChI

InChI=1S/C13H19N3.C2H2O4/c1-3-5-10(6-4-2)13-15-11-7-8-14-9-12(11)16-13;3-1(4)2(5)6/h7-10H,3-6H2,1-2H3,(H,15,16);(H,3,4)(H,5,6)