ethyl (4S)-4-(4-ethylphenyl)-2-methyl-5-oxidanylidene-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate

Systemtic Name: ethyl (4S)-4-(4-ethylphenyl)-2-methyl-5-oxidanylidene-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Openeye Name: ethyl (4S)-4-(4-ethylphenyl)-2-methyl-5-oxo-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate CAS Name: (4S)-4-(4-ethylphenyl)-2-methyl-5-oxo-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-4-(4-ethylphenyl)-2-methyl-5-oxo-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Traditional Name: (4S)-4-(4-ethylphenyl)-5-keto-2-methyl-4a,6,7,8-tetrahydro-4H-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(=NC(=C2C(=O)OCC)C)CCCC3=O

Isomeric SMILES

CCC1=CC=C(C=C1)[C@@H]2C3C(=NC(=C2C(=O)OCC)C)CCCC3=O

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/h9-12,19-20H,4-8H2,1-3H3/t19-,20?/m0/s1