2-phenoxyethyl (4R)-2,7,7-trimethyl-5-oxidanylidene-4-pyridin-3-yl-1,4,6,8-tetrahydroquinoline-3-carboxylate

Systemtic Name: 2-phenoxyethyl (4R)-2,7,7-trimethyl-5-oxidanylidene-4-pyridin-3-yl-1,4,6,8-tetrahydroquinoline-3-carboxylate Openeye Name: 2-phenoxyethyl (4R)-2,7,7-trimethyl-5-oxo-4-(3-pyridyl)-1,4,6,8-tetrahydroquinoline-3-carboxylate CAS Name: (4R)-2,7,7-trimethyl-5-oxo-4-(3-pyridinyl)-1,4,6,8-tetrahydroquinoline-3-carboxylic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl (4R)-2,7,7-trimethyl-5-oxo-4-pyridin-3-yl-1,4,6,8-tetrahydroquinoline-3-carboxylate Traditional Name: (4R)-5-keto-2,7,7-trimethyl-4-(3-pyridyl)-1,4,6,8-tetrahydroquinoline-3-carboxylic acid 2-phenoxyethyl ester Formula: C26H28N2O4 MolecularWeight: 432.51152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CN=CC=C3)C(=O)OCCOC4=CC=CC=C4

Isomeric SMILES

CC1=C([C@@H](C2=C(N1)CC(CC2=O)(C)C)C3=CN=CC=C3)C(=O)OCCOC4=CC=CC=C4

InChI

InChI=1S/C26H28N2O4/c1-17-22(25(30)32-13-12-31-19-9-5-4-6-10-19)23(18-8-7-11-27-16-18)24-20(28-17)14-26(2,3)15-21(24)29/h4-11,16,23,28H,12-15H2,1-3H3/t23-/m0/s1