phenyl 3-butoxy-1-methyl-2-oxidanyl-4-oxidanylidene-quinoline-5-carboxylate

Systemtic Name: phenyl 3-butoxy-1-methyl-2-oxidanyl-4-oxidanylidene-quinoline-5-carboxylate Openeye Name: phenyl 3-butoxy-2-hydroxy-1-methyl-4-oxo-quinoline-5-carboxylate CAS Name: 3-butoxy-2-hydroxy-1-methyl-4-oxo-5-quinolinecarboxylic acid phenyl ester IUPAC Name: phenyl 3-butoxy-2-hydroxy-1-methyl-4-oxoquinoline-5-carboxylate Traditional Name: 3-butoxy-2-hydroxy-4-keto-1-methyl-quinoline-5-carboxylic acid phenyl ester Formula: C21H21NO5 MolecularWeight: 367.39514

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(N(C2=CC=CC(=C2C1=O)C(=O)OC3=CC=CC=C3)C)O

Isomeric SMILES

CCCCOC1=C(N(C2=CC=CC(=C2C1=O)C(=O)OC3=CC=CC=C3)C)O

InChI

InChI=1S/C21H21NO5/c1-3-4-13-26-19-18(23)17-15(11-8-12-16(17)22(2)20(19)24)21(25)27-14-9-6-5-7-10-14/h5-12,24H,3-4,13H2,1-2H3