4-(5,6-dimethylbenzimidazol-1-yl)butanoate

Systemtic Name: 4-(5,6-dimethylbenzimidazol-1-yl)butanoate Openeye Name: 4-(5,6-dimethylbenzimidazol-1-yl)butanoate CAS Name: 4-(5,6-dimethyl-1-benzimidazolyl)butanoate IUPAC Name: 4-(5,6-dimethylbenzimidazol-1-yl)butanoate Traditional Name: 4-(5,6-dimethylbenzimidazol-1-yl)butyrate Formula: C13H15N2O2- MolecularWeight: 231.2704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O2/c1-9-6-11-12(7-10(9)2)15(8-14-11)5-3-4-13(16)17/h6-8H,3-5H2,1-2H3,(H,16,17)/p-1