ethanedioic acid; N-ethyl-4-(1H-imidazol-5-yl)butan-1-amine

Systemtic Name: ethanedioic acid; N-ethyl-4-(1H-imidazol-5-yl)butan-1-amine Openeye Name: N-ethyl-4-(1H-imidazol-5-yl)butan-1-amine; oxalic acid CAS Name: N-ethyl-4-(1H-imidazol-5-yl)-1-butanamine; oxalic acid IUPAC Name: N-ethyl-4-(1H-imidazol-5-yl)butan-1-amine; oxalic acid Traditional Name: ethyl-[4-(1H-imidazol-5-yl)butyl]amine; oxalic acid Formula: C11H19N3O4 MolecularWeight: 257.28626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNCCCCC1=CN=CN1.C(=O)(C(=O)O)O

Isomeric SMILES

CCNCCCCC1=CN=CN1.C(=O)(C(=O)O)O

InChI

InChI=1S/C9H17N3.C2H2O4/c1-2-10-6-4-3-5-9-7-11-8-12-9;3-1(4)2(5)6/h7-8,10H,2-6H2,1H3,(H,11,12);(H,3,4)(H,5,6)