3-methyl-4-oxidanylidene-4-[4-(4,5,6,7-tetrahydrobenzimidazol-1-yl)phenyl]butanoic acid

Systemtic Name: 3-methyl-4-oxidanylidene-4-[4-(4,5,6,7-tetrahydrobenzimidazol-1-yl)phenyl]butanoic acid Openeye Name: 3-methyl-4-oxo-4-[4-(4,5,6,7-tetrahydrobenzimidazol-1-yl)phenyl]butanoic acid CAS Name: 3-methyl-4-oxo-4-[4-(4,5,6,7-tetrahydrobenzimidazol-1-yl)phenyl]butanoic acid IUPAC Name: 3-methyl-4-oxo-4-[4-(4,5,6,7-tetrahydrobenzimidazol-1-yl)phenyl]butanoic acid Traditional Name: 4-keto-3-methyl-4-[4-(4,5,6,7-tetrahydrobenzimidazol-1-yl)phenyl]butyric acid Formula: C18H20N2O3 MolecularWeight: 312.363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)C(=O)C1=CC=C(C=C1)N2C=NC3=C2CCCC3

Isomeric SMILES

CC(CC(=O)O)C(=O)C1=CC=C(C=C1)N2C=NC3=C2CCCC3

InChI

InChI=1S/C18H20N2O3/c1-12(10-17(21)22)18(23)13-6-8-14(9-7-13)20-11-19-15-4-2-3-5-16(15)20/h6-9,11-12H,2-5,10H2,1H3,(H,21,22)