5,7-dimethyl-2-(5-methylfuran-2-yl)quinoline-4-carboxylic acid

Systemtic Name: 5,7-dimethyl-2-(5-methylfuran-2-yl)quinoline-4-carboxylic acid Openeye Name: 5,7-dimethyl-2-(5-methyl-2-furyl)quinoline-4-carboxylic acid CAS Name: 5,7-dimethyl-2-(5-methyl-2-furanyl)-4-quinolinecarboxylic acid IUPAC Name: 5,7-dimethyl-2-(5-methylfuran-2-yl)quinoline-4-carboxylic acid Traditional Name: 5,7-dimethyl-2-(5-methyl-2-furyl)cinchoninic acid Formula: C17H15NO3 MolecularWeight: 281.3059

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2=NC3=CC(=CC(=C3C(=C2)C(=O)O)C)C

Isomeric SMILES

CC1=CC=C(O1)C2=NC3=CC(=CC(=C3C(=C2)C(=O)O)C)C

InChI

InChI=1S/C17H15NO3/c1-9-6-10(2)16-12(17(19)20)8-13(18-14(16)7-9)15-5-4-11(3)21-15/h4-8H,1-3H3,(H,19,20)