3-[4-(benzimidazol-1-yl)phenyl]-2,2-dimethyl-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[4-(benzimidazol-1-yl)phenyl]-2,2-dimethyl-3-oxidanylidene-propanoic acid Openeye Name: 3-[4-(benzimidazol-1-yl)phenyl]-2,2-dimethyl-3-oxo-propanoic acid CAS Name: 3-[4-(1-benzimidazolyl)phenyl]-2,2-dimethyl-3-oxopropanoic acid IUPAC Name: 3-[4-(benzimidazol-1-yl)phenyl]-2,2-dimethyl-3-oxopropanoic acid Traditional Name: 3-[4-(benzimidazol-1-yl)phenyl]-3-keto-2,2-dimethyl-propionic acid Formula: C18H16N2O3 MolecularWeight: 308.33124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)C1=CC=C(C=C1)N2C=NC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CC(C)(C(=O)C1=CC=C(C=C1)N2C=NC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C18H16N2O3/c1-18(2,17(22)23)16(21)12-7-9-13(10-8-12)20-11-19-14-5-3-4-6-15(14)20/h3-11H,1-2H3,(H,22,23)