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

Systemtic Name: (2-oxidanylidenecyclohexyl) 2-ethyl-3-methyl-quinoline-4-carboxylate Openeye Name: (2-oxocyclohexyl) 2-ethyl-3-methyl-quinoline-4-carboxylate CAS Name: 2-ethyl-3-methyl-4-quinolinecarboxylic acid (2-oxocyclohexyl) ester IUPAC Name: (2-oxocyclohexyl) 2-ethyl-3-methylquinoline-4-carboxylate Traditional Name: 2-ethyl-3-methyl-cinchoninic acid (2-ketocyclohexyl) ester Formula: C19H21NO3 MolecularWeight: 311.37494

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OC3CCCCC3=O

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OC3CCCCC3=O

InChI

InChI=1S/C19H21NO3/c1-3-14-12(2)18(13-8-4-5-9-15(13)20-14)19(22)23-17-11-7-6-10-16(17)21/h4-5,8-9,17H,3,6-7,10-11H2,1-2H3