hexyl 7-chloranyl-2,8-dimethyl-quinoline-4-carboxylate

Systemtic Name: hexyl 7-chloranyl-2,8-dimethyl-quinoline-4-carboxylate Openeye Name: hexyl 7-chloro-2,8-dimethyl-quinoline-4-carboxylate CAS Name: 7-chloro-2,8-dimethyl-4-quinolinecarboxylic acid hexyl ester IUPAC Name: hexyl 7-chloro-2,8-dimethylquinoline-4-carboxylate Traditional Name: 7-chloro-2,8-dimethyl-cinchoninic acid hexyl ester Formula: C18H22ClNO2 MolecularWeight: 319.82578

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CC(=NC2=C1C=CC(=C2C)Cl)C

Isomeric SMILES

CCCCCCOC(=O)C1=CC(=NC2=C1C=CC(=C2C)Cl)C

InChI

InChI=1S/C18H22ClNO2/c1-4-5-6-7-10-22-18(21)15-11-12(2)20-17-13(3)16(19)9-8-14(15)17/h8-9,11H,4-7,10H2,1-3H3