3-(2,6-diethylphenyl)imidazole-4-carboxylic acid

Systemtic Name: 3-(2,6-diethylphenyl)imidazole-4-carboxylic acid Openeye Name: 3-(2,6-diethylphenyl)imidazole-4-carboxylic acid CAS Name: 3-(2,6-diethylphenyl)-4-imidazolecarboxylic acid IUPAC Name: 3-(2,6-diethylphenyl)imidazole-4-carboxylic acid Traditional Name: 3-(2,6-diethylphenyl)imidazole-4-carboxylic acid Formula: C14H16N2O2 MolecularWeight: 244.28904

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)N2C=NC=C2C(=O)O

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)N2C=NC=C2C(=O)O

InChI

InChI=1S/C14H16N2O2/c1-3-10-6-5-7-11(4-2)13(10)16-9-15-8-12(16)14(17)18/h5-9H,3-4H2,1-2H3,(H,17,18)