ethyl 2,7,7-trimethyl-5-oxidanylidene-4-(3-phenoxyphenyl)-1,4,6,8-tetrahydroquinoline-3-carboxylate

Systemtic Name: ethyl 2,7,7-trimethyl-5-oxidanylidene-4-(3-phenoxyphenyl)-1,4,6,8-tetrahydroquinoline-3-carboxylate Openeye Name: ethyl 2,7,7-trimethyl-5-oxo-4-(3-phenoxyphenyl)-1,4,6,8-tetrahydroquinoline-3-carboxylate CAS Name: 2,7,7-trimethyl-5-oxo-4-(3-phenoxyphenyl)-1,4,6,8-tetrahydroquinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,7,7-trimethyl-5-oxo-4-(3-phenoxyphenyl)-1,4,6,8-tetrahydroquinoline-3-carboxylate Traditional Name: 5-keto-2,7,7-trimethyl-4-(3-phenoxyphenyl)-1,4,6,8-tetrahydroquinoline-3-carboxylic acid ethyl ester Formula: C27H29NO4 MolecularWeight: 431.52346

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=C(C1C3=CC(=CC=C3)OC4=CC=CC=C4)C(=O)CC(C2)(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC2=C(C1C3=CC(=CC=C3)OC4=CC=CC=C4)C(=O)CC(C2)(C)C)C

InChI

InChI=1S/C27H29NO4/c1-5-31-26(30)23-17(2)28-21-15-27(3,4)16-22(29)25(21)24(23)18-10-9-13-20(14-18)32-19-11-7-6-8-12-19/h6-14,24,28H,5,15-16H2,1-4H3