ethyl 6-butyl-4-oxidanylidene-3-phenyl-1H-quinoline-2-carboxylate

Systemtic Name: ethyl 6-butyl-4-oxidanylidene-3-phenyl-1H-quinoline-2-carboxylate Openeye Name: ethyl 6-butyl-4-oxo-3-phenyl-1H-quinoline-2-carboxylate CAS Name: 6-butyl-4-oxo-3-phenyl-1H-quinoline-2-carboxylic acid ethyl ester IUPAC Name: ethyl 6-butyl-4-oxo-3-phenyl-1H-quinoline-2-carboxylate Traditional Name: 6-butyl-4-keto-3-phenyl-1H-quinoline-2-carboxylic acid ethyl ester Formula: C22H23NO3 MolecularWeight: 349.42292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)NC(=C(C2=O)C3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCCCC1=CC2=C(C=C1)NC(=C(C2=O)C3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C22H23NO3/c1-3-5-9-15-12-13-18-17(14-15)21(24)19(16-10-7-6-8-11-16)20(23-18)22(25)26-4-2/h6-8,10-14H,3-5,9H2,1-2H3,(H,23,24)