4-[4-(2-ethyl-4-methyl-imidazol-1-yl)phenyl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[4-(2-ethyl-4-methyl-imidazol-1-yl)phenyl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-(2-ethyl-4-methyl-imidazol-1-yl)phenyl]-4-oxo-butanoic acid CAS Name: 4-[4-(2-ethyl-4-methyl-1-imidazolyl)phenyl]-4-oxobutanoic acid IUPAC Name: 4-[4-(2-ethyl-4-methylimidazol-1-yl)phenyl]-4-oxobutanoic acid Traditional Name: 4-[4-(2-ethyl-4-methyl-imidazol-1-yl)phenyl]-4-keto-butyric acid Formula: C16H18N2O3 MolecularWeight: 286.32572

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=CN1C2=CC=C(C=C2)C(=O)CCC(=O)O)C

Isomeric SMILES

CCC1=NC(=CN1C2=CC=C(C=C2)C(=O)CCC(=O)O)C

InChI

InChI=1S/C16H18N2O3/c1-3-15-17-11(2)10-18(15)13-6-4-12(5-7-13)14(19)8-9-16(20)21/h4-7,10H,3,8-9H2,1-2H3,(H,20,21)