2-methyl-5-[(2-propan-2-ylimidazol-1-yl)methyl]furan-3-carboxylic acid

Systemtic Name: 2-methyl-5-[(2-propan-2-ylimidazol-1-yl)methyl]furan-3-carboxylic acid Openeye Name: 5-[(2-isopropylimidazol-1-yl)methyl]-2-methyl-furan-3-carboxylic acid CAS Name: 2-methyl-5-[(2-propan-2-yl-1-imidazolyl)methyl]-3-furancarboxylic acid IUPAC Name: 2-methyl-5-[(2-propan-2-ylimidazol-1-yl)methyl]furan-3-carboxylic acid Traditional Name: 5-[(2-isopropylimidazol-1-yl)methyl]-2-methyl-3-furoic acid Formula: C13H16N2O3 MolecularWeight: 248.27774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CN2C=CN=C2C(C)C)C(=O)O

Isomeric SMILES

CC1=C(C=C(O1)CN2C=CN=C2C(C)C)C(=O)O

InChI

InChI=1S/C13H16N2O3/c1-8(2)12-14-4-5-15(12)7-10-6-11(13(16)17)9(3)18-10/h4-6,8H,7H2,1-3H3,(H,16,17)