2-ethoxyethyl (4S)-2,7,7-trimethyl-5-oxidanylidene-4-(2-propan-2-yloxyphenyl)-1,4,6,8-tetrahydroquinoline-3-carboxylate

Systemtic Name: 2-ethoxyethyl (4S)-2,7,7-trimethyl-5-oxidanylidene-4-(2-propan-2-yloxyphenyl)-1,4,6,8-tetrahydroquinoline-3-carboxylate Openeye Name: 2-ethoxyethyl (4S)-4-(2-isopropoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate CAS Name: (4S)-2,7,7-trimethyl-5-oxo-4-(2-propan-2-yloxyphenyl)-1,4,6,8-tetrahydroquinoline-3-carboxylic acid 2-ethoxyethyl ester IUPAC Name: 2-ethoxyethyl (4S)-2,7,7-trimethyl-5-oxo-4-(2-propan-2-yloxyphenyl)-1,4,6,8-tetrahydroquinoline-3-carboxylate Traditional Name: (4S)-4-(2-isopropoxyphenyl)-5-keto-2,7,7-trimethyl-1,4,6,8-tetrahydroquinoline-3-carboxylic acid 2-ethoxyethyl ester Formula: C26H35NO5 MolecularWeight: 441.5598

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC(=O)C1=C(NC2=C(C1C3=CC=CC=C3OC(C)C)C(=O)CC(C2)(C)C)C

Isomeric SMILES

CCOCCOC(=O)C1=C(NC2=C([C@@H]1C3=CC=CC=C3OC(C)C)C(=O)CC(C2)(C)C)C

InChI

InChI=1S/C26H35NO5/c1-7-30-12-13-31-25(29)22-17(4)27-19-14-26(5,6)15-20(28)24(19)23(22)18-10-8-9-11-21(18)32-16(2)3/h8-11,16,23,27H,7,12-15H2,1-6H3/t23-/m1/s1