(4-cyanophenyl) 2-ethyl-3-methyl-quinoline-4-carboxylate

Systemtic Name: (4-cyanophenyl) 2-ethyl-3-methyl-quinoline-4-carboxylate Openeye Name: (4-cyanophenyl) 2-ethyl-3-methyl-quinoline-4-carboxylate CAS Name: 2-ethyl-3-methyl-4-quinolinecarboxylic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 2-ethyl-3-methylquinoline-4-carboxylate Traditional Name: 2-ethyl-3-methyl-cinchoninic acid (4-cyanophenyl) ester Formula: C20H16N2O2 MolecularWeight: 316.35324

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OC3=CC=C(C=C3)C#N

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OC3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H16N2O2/c1-3-17-13(2)19(16-6-4-5-7-18(16)22-17)20(23)24-15-10-8-14(12-21)9-11-15/h4-11H,3H2,1-2H3