(3-butanoyl-8-methoxy-4-oxidanylidene-1H-quinolin-6-yl) benzoate

Systemtic Name: (3-butanoyl-8-methoxy-4-oxidanylidene-1H-quinolin-6-yl) benzoate Openeye Name: (3-butanoyl-8-methoxy-4-oxo-1H-quinolin-6-yl) benzoate CAS Name: benzoic acid [8-methoxy-4-oxo-3-(1-oxobutyl)-1H-quinolin-6-yl] ester IUPAC Name: (3-butanoyl-8-methoxy-4-oxo-1H-quinolin-6-yl) benzoate Traditional Name: benzoic acid (3-butyryl-4-keto-8-methoxy-1H-quinolin-6-yl) ester Formula: C21H19NO5 MolecularWeight: 365.37926

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CNC2=C(C=C(C=C2C1=O)OC(=O)C3=CC=CC=C3)OC

Isomeric SMILES

CCCC(=O)C1=CNC2=C(C=C(C=C2C1=O)OC(=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C21H19NO5/c1-3-7-17(23)16-12-22-19-15(20(16)24)10-14(11-18(19)26-2)27-21(25)13-8-5-4-6-9-13/h4-6,8-12H,3,7H2,1-2H3,(H,22,24)