2-ethoxyethyl (4R,4aR)-4-(3-chlorophenyl)-2-methyl-5-oxidanylidene-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate

Systemtic Name: 2-ethoxyethyl (4R,4aR)-4-(3-chlorophenyl)-2-methyl-5-oxidanylidene-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Openeye Name: 2-ethoxyethyl (4R,4aR)-4-(3-chlorophenyl)-2-methyl-5-oxo-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate CAS Name: (4R,4aR)-4-(3-chlorophenyl)-2-methyl-5-oxo-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylic acid 2-ethoxyethyl ester IUPAC Name: 2-ethoxyethyl (4R,4aR)-4-(3-chlorophenyl)-2-methyl-5-oxo-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Traditional Name: (4R,4aR)-4-(3-chlorophenyl)-5-keto-2-methyl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylic acid 2-ethoxyethyl ester Formula: C21H24ClNO4 MolecularWeight: 389.87256

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC(=O)C1=C(N=C2CCCC(=O)C2C1C3=CC(=CC=C3)Cl)C

Isomeric SMILES

CCOCCOC(=O)C1=C(N=C2CCCC(=O)[C@@H]2[C@@H]1C3=CC(=CC=C3)Cl)C

InChI

InChI=1S/C21H24ClNO4/c1-3-26-10-11-27-21(25)18-13(2)23-16-8-5-9-17(24)20(16)19(18)14-6-4-7-15(22)12-14/h4,6-7,12,19-20H,3,5,8-11H2,1-2H3/t19-,20-/m1/s1