butyl 2-(2-azanylidene-3-propyl-benzimidazol-1-yl)ethanoate hydrochloride

Systemtic Name: butyl 2-(2-azanylidene-3-propyl-benzimidazol-1-yl)ethanoate hydrochloride Openeye Name: butyl 2-(2-imino-3-propyl-benzimidazol-1-yl)acetate hydrochloride CAS Name: 2-(2-imino-3-propyl-1-benzimidazolyl)acetic acid butyl ester hydrochloride IUPAC Name: butyl 2-(2-imino-3-propylbenzimidazol-1-yl)acetate hydrochloride Traditional Name: 2-(2-imino-3-propyl-benzimidazol-1-yl)acetic acid butyl ester hydrochloride Formula: C16H24ClN3O2 MolecularWeight: 325.83366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CN1C2=CC=CC=C2N(C1=N)CCC.Cl

Isomeric SMILES

CCCCOC(=O)CN1C2=CC=CC=C2N(C1=N)CCC.Cl

InChI

InChI=1S/C16H23N3O2.ClH/c1-3-5-11-21-15(20)12-19-14-9-7-6-8-13(14)18(10-4-2)16(19)17;/h6-9,17H,3-5,10-12H2,1-2H3;1H