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

Systemtic Name: hexyl 2-methyl-5-oxidanylidene-4-phenyl-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylate Openeye Name: hexyl 2-methyl-5-oxo-4-phenyl-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylate CAS Name: 2-methyl-5-oxo-4-phenyl-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylic acid hexyl ester IUPAC Name: hexyl 2-methyl-5-oxo-4-phenyl-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylate Traditional Name: 5-keto-2-methyl-4-phenyl-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylic acid hexyl ester Formula: C21H25NO4 MolecularWeight: 355.4275

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25NO4/c1-3-4-5-9-12-25-20(23)17-14(2)22-16-13-26-21(24)19(16)18(17)15-10-7-6-8-11-15/h6-8,10-11,18,22H,3-5,9,12-13H2,1-2H3