2-(4-imidazol-1-ylphenyl)carbonyl-2-methyl-butanoic acid

Systemtic Name: 2-(4-imidazol-1-ylphenyl)carbonyl-2-methyl-butanoic acid Openeye Name: 2-(4-imidazol-1-ylbenzoyl)-2-methyl-butanoic acid CAS Name: 2-[[4-(1-imidazolyl)phenyl]-oxomethyl]-2-methylbutanoic acid IUPAC Name: 2-(4-imidazol-1-ylbenzoyl)-2-methylbutanoic acid Traditional Name: 2-(4-imidazol-1-ylbenzoyl)-2-methyl-butyric acid Formula: C15H16N2O3 MolecularWeight: 272.29914

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C(=O)C1=CC=C(C=C1)N2C=CN=C2)C(=O)O

Isomeric SMILES

CCC(C)(C(=O)C1=CC=C(C=C1)N2C=CN=C2)C(=O)O

InChI

InChI=1S/C15H16N2O3/c1-3-15(2,14(19)20)13(18)11-4-6-12(7-5-11)17-9-8-16-10-17/h4-10H,3H2,1-2H3,(H,19,20)