3-cyanopropyl 2-(5-methylfuran-2-yl)quinoline-4-carboxylate

Systemtic Name: 3-cyanopropyl 2-(5-methylfuran-2-yl)quinoline-4-carboxylate Openeye Name: 3-cyanopropyl 2-(5-methyl-2-furyl)quinoline-4-carboxylate CAS Name: 2-(5-methyl-2-furanyl)-4-quinolinecarboxylic acid 3-cyanopropyl ester IUPAC Name: 3-cyanopropyl 2-(5-methylfuran-2-yl)quinoline-4-carboxylate Traditional Name: 2-(5-methyl-2-furyl)cinchoninic acid 3-cyanopropyl ester Formula: C19H16N2O3 MolecularWeight: 320.34194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCCCC#N

Isomeric SMILES

CC1=CC=C(O1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCCCC#N

InChI

InChI=1S/C19H16N2O3/c1-13-8-9-18(24-13)17-12-15(19(22)23-11-5-4-10-20)14-6-2-3-7-16(14)21-17/h2-3,6-9,12H,4-5,11H2,1H3