(2R)-2-(5,6-dimethylbenzimidazol-1-yl)-3-methyl-butanoate

Systemtic Name: (2R)-2-(5,6-dimethylbenzimidazol-1-yl)-3-methyl-butanoate Openeye Name: (2R)-2-(5,6-dimethylbenzimidazol-1-yl)-3-methyl-butanoate CAS Name: (2R)-2-(5,6-dimethyl-1-benzimidazolyl)-3-methylbutanoate IUPAC Name: (2R)-2-(5,6-dimethylbenzimidazol-1-yl)-3-methylbutanoate Traditional Name: (2R)-2-(5,6-dimethylbenzimidazol-1-yl)-3-methyl-butyrate Formula: C14H17N2O2- MolecularWeight: 245.29698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C=N2)C(C(C)C)C(=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C=N2)[C@H](C(C)C)C(=O)[O-]

InChI

InChI=1S/C14H18N2O2/c1-8(2)13(14(17)18)16-7-15-11-5-9(3)10(4)6-12(11)16/h5-8,13H,1-4H3,(H,17,18)/p-1/t13-/m1/s1