methyl 2-azanyl-4-(1H-benzimidazol-2-yl)butanoate dihydrochloride

Systemtic Name: methyl 2-azanyl-4-(1H-benzimidazol-2-yl)butanoate dihydrochloride Openeye Name: methyl 2-amino-4-(1H-benzimidazol-2-yl)butanoate dihydrochloride CAS Name: 2-amino-4-(1H-benzimidazol-2-yl)butanoic acid methyl ester dihydrochloride IUPAC Name: methyl 2-amino-4-(1H-benzimidazol-2-yl)butanoate dihydrochloride Traditional Name: 2-amino-4-(1H-benzimidazol-2-yl)butyric acid methyl ester dihydrochloride Formula: C12H17Cl2N3O2 MolecularWeight: 306.18828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCC1=NC2=CC=CC=C2N1)N.Cl.Cl

Isomeric SMILES

COC(=O)C(CCC1=NC2=CC=CC=C2N1)N.Cl.Cl

InChI

InChI=1S/C12H15N3O2.2ClH/c1-17-12(16)8(13)6-7-11-14-9-4-2-3-5-10(9)15-11;;/h2-5,8H,6-7,13H2,1H3,(H,14,15);2*1H