hexyl 4-(3-chlorophenyl)-2-methyl-5-oxidanylidene-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylate

Systemtic Name: hexyl 4-(3-chlorophenyl)-2-methyl-5-oxidanylidene-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylate Openeye Name: hexyl 4-(3-chlorophenyl)-2-methyl-5-oxo-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylate CAS Name: 4-(3-chlorophenyl)-2-methyl-5-oxo-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylic acid hexyl ester IUPAC Name: hexyl 4-(3-chlorophenyl)-2-methyl-5-oxo-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylate Traditional Name: 4-(3-chlorophenyl)-5-keto-2-methyl-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylic acid hexyl ester Formula: C21H24ClNO4 MolecularWeight: 389.87256

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=C(NC2=C(C1C3=CC(=CC=C3)Cl)C(=O)OC2)C

Isomeric SMILES

CCCCCCOC(=O)C1=C(NC2=C(C1C3=CC(=CC=C3)Cl)C(=O)OC2)C

InChI

InChI=1S/C21H24ClNO4/c1-3-4-5-6-10-26-20(24)17-13(2)23-16-12-27-21(25)19(16)18(17)14-8-7-9-15(22)11-14/h7-9,11,18,23H,3-6,10,12H2,1-2H3