3,6-dimethyl-2-(5-methylfuran-2-yl)quinoline-4-carboxylate

Systemtic Name: 3,6-dimethyl-2-(5-methylfuran-2-yl)quinoline-4-carboxylate Openeye Name: 3,6-dimethyl-2-(5-methyl-2-furyl)quinoline-4-carboxylate CAS Name: 3,6-dimethyl-2-(5-methyl-2-furanyl)-4-quinolinecarboxylate IUPAC Name: 3,6-dimethyl-2-(5-methylfuran-2-yl)quinoline-4-carboxylate Traditional Name: 3,6-dimethyl-2-(5-methyl-2-furyl)cinchoninate Formula: C17H14NO3- MolecularWeight: 280.29796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C(N=C2C=C1)C3=CC=C(O3)C)C)C(=O)[O-]

Isomeric SMILES

CC1=CC2=C(C(=C(N=C2C=C1)C3=CC=C(O3)C)C)C(=O)[O-]

InChI

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