ethyl 4-(4-ethylphenyl)-2-methyl-5-oxidanylidene-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 4-(4-ethylphenyl)-2-methyl-5-oxidanylidene-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate Openeye Name: ethyl 4-(4-ethylphenyl)-2-methyl-5-oxo-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate CAS Name: 4-(4-ethylphenyl)-2-methyl-5-oxo-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-ethylphenyl)-2-methyl-5-oxo-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate Traditional Name: 4-(4-ethylphenyl)-5-keto-2-methyl-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylic acid ethyl ester Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2C3C(=O)CCC=C3NC(=C2C(=O)OCC)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2C3C(=O)CCC=C3NC(=C2C(=O)OCC)C

InChI

InChI=1S/C21H25NO3/c1-4-14-9-11-15(12-10-14)19-18(21(24)25-5-2)13(3)22-16-7-6-8-17(23)20(16)19/h7,9-12,19-20,22H,4-6,8H2,1-3H3