(7-ethyl-2-oxidanylidene-chromen-4-yl)methyl quinoline-2-carboxylate

Systemtic Name: (7-ethyl-2-oxidanylidene-chromen-4-yl)methyl quinoline-2-carboxylate Openeye Name: (7-ethyl-2-oxo-chromen-4-yl)methyl quinoline-2-carboxylate CAS Name: 2-quinolinecarboxylic acid (7-ethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-ethyl-2-oxochromen-4-yl)methyl quinoline-2-carboxylate Traditional Name: quinaldic acid (7-ethyl-2-keto-chromen-4-yl)methyl ester Formula: C22H17NO4 MolecularWeight: 359.37468

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H17NO4/c1-2-14-7-9-17-16(12-21(24)27-20(17)11-14)13-26-22(25)19-10-8-15-5-3-4-6-18(15)23-19/h3-12H,2,13H2,1H3