(6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 2-oxidanylidene-1H-quinoline-4-carboxylate

Systemtic Name: (6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 2-oxidanylidene-1H-quinoline-4-carboxylate Openeye Name: (6-ethyl-7-hydroxy-2-oxo-chromen-4-yl)methyl 2-oxo-1H-quinoline-4-carboxylate CAS Name: 2-oxo-1H-quinoline-4-carboxylic acid (6-ethyl-7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-ethyl-7-hydroxy-2-oxochromen-4-yl)methyl 2-oxo-1H-quinoline-4-carboxylate Traditional Name: 2-keto-1H-quinoline-4-carboxylic acid (6-ethyl-7-hydroxy-2-keto-chromen-4-yl)methyl ester Formula: C22H17NO6 MolecularWeight: 391.37348

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C3=CC(=O)NC4=CC=CC=C43)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C3=CC(=O)NC4=CC=CC=C43)O

InChI

InChI=1S/C22H17NO6/c1-2-12-7-15-13(8-21(26)29-19(15)10-18(12)24)11-28-22(27)16-9-20(25)23-17-6-4-3-5-14(16)17/h3-10,24H,2,11H2,1H3,(H,23,25)