3-(5,6-dimethylbenzimidazol-1-yl)propanoate

Systemtic Name: 3-(5,6-dimethylbenzimidazol-1-yl)propanoate Openeye Name: 3-(5,6-dimethylbenzimidazol-1-yl)propanoate CAS Name: 3-(5,6-dimethyl-1-benzimidazolyl)propanoate IUPAC Name: 3-(5,6-dimethylbenzimidazol-1-yl)propanoate Traditional Name: 3-(5,6-dimethylbenzimidazol-1-yl)propionate Formula: C12H13N2O2- MolecularWeight: 217.24382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N2O2/c1-8-5-10-11(6-9(8)2)14(7-13-10)4-3-12(15)16/h5-7H,3-4H2,1-2H3,(H,15,16)/p-1