ethyl 2-ethyl-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxidanylidene-1,4,4a,6-tetrahydroquinoline-3-carboxylate

Systemtic Name: ethyl 2-ethyl-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxidanylidene-1,4,4a,6-tetrahydroquinoline-3-carboxylate Openeye Name: ethyl 2-ethyl-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,4a,6-tetrahydroquinoline-3-carboxylate CAS Name: 2-ethyl-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,4a,6-tetrahydroquinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-ethyl-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,4a,6-tetrahydroquinoline-3-carboxylate Traditional Name: 2-ethyl-5-keto-4-(4-methoxyphenyl)-7,7-dimethyl-1,4,4a,6-tetrahydroquinoline-3-carboxylic acid ethyl ester Formula: C23H29NO4 MolecularWeight: 383.48066

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(C2C(=O)CC(C=C2N1)(C)C)C3=CC=C(C=C3)OC)C(=O)OCC

Isomeric SMILES

CCC1=C(C(C2C(=O)CC(C=C2N1)(C)C)C3=CC=C(C=C3)OC)C(=O)OCC

InChI

InChI=1S/C23H29NO4/c1-6-16-21(22(26)28-7-2)19(14-8-10-15(27-5)11-9-14)20-17(24-16)12-23(3,4)13-18(20)25/h8-12,19-20,24H,6-7,13H2,1-5H3