2-(furan-2-yl)-5,7-dimethyl-quinoline-4-carboxylate

Systemtic Name: 2-(furan-2-yl)-5,7-dimethyl-quinoline-4-carboxylate Openeye Name: 2-(2-furyl)-5,7-dimethyl-quinoline-4-carboxylate CAS Name: 2-(2-furanyl)-5,7-dimethyl-4-quinolinecarboxylate IUPAC Name: 2-(furan-2-yl)-5,7-dimethylquinoline-4-carboxylate Traditional Name: 2-(2-furyl)-5,7-dimethyl-cinchoninate Formula: C16H12NO3- MolecularWeight: 266.27138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=CC(=NC2=C1)C3=CC=CO3)C(=O)[O-])C

Isomeric SMILES

CC1=CC(=C2C(=CC(=NC2=C1)C3=CC=CO3)C(=O)[O-])C

InChI

InChI=1S/C16H13NO3/c1-9-6-10(2)15-11(16(18)19)8-12(17-13(15)7-9)14-4-3-5-20-14/h3-8H,1-2H3,(H,18,19)/p-1