7,8-dimethyl-2-(5-methylfuran-2-yl)quinoline-4-carboxylic acid

Systemtic Name: 7,8-dimethyl-2-(5-methylfuran-2-yl)quinoline-4-carboxylic acid Openeye Name: 7,8-dimethyl-2-(5-methyl-2-furyl)quinoline-4-carboxylic acid CAS Name: 7,8-dimethyl-2-(5-methyl-2-furanyl)-4-quinolinecarboxylic acid IUPAC Name: 7,8-dimethyl-2-(5-methylfuran-2-yl)quinoline-4-carboxylic acid Traditional Name: 7,8-dimethyl-2-(5-methyl-2-furyl)cinchoninic acid Formula: C17H15NO3 MolecularWeight: 281.3059

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=N2)C3=CC=C(O3)C)C(=O)O)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=N2)C3=CC=C(O3)C)C(=O)O)C

InChI

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