(4-methoxyphenyl)methyl (4S)-2,7,7-trimethyl-5-oxidanylidene-4-pyridin-4-yl-3,4,6,8-tetrahydroquinoline-3-carboxylate

Systemtic Name: (4-methoxyphenyl)methyl (4S)-2,7,7-trimethyl-5-oxidanylidene-4-pyridin-4-yl-3,4,6,8-tetrahydroquinoline-3-carboxylate Openeye Name: (4-methoxyphenyl)methyl (4S)-2,7,7-trimethyl-5-oxo-4-(4-pyridyl)-3,4,6,8-tetrahydroquinoline-3-carboxylate CAS Name: (4S)-2,7,7-trimethyl-5-oxo-4-pyridin-4-yl-3,4,6,8-tetrahydroquinoline-3-carboxylic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl (4S)-2,7,7-trimethyl-5-oxo-4-pyridin-4-yl-3,4,6,8-tetrahydroquinoline-3-carboxylate Traditional Name: (4S)-5-keto-2,7,7-trimethyl-4-(4-pyridyl)-3,4,6,8-tetrahydroquinoline-3-carboxylic acid p-anisyl ester Formula: C26H28N2O4 MolecularWeight: 432.51152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(C1C(=O)OCC3=CC=C(C=C3)OC)C4=CC=NC=C4)C(=O)CC(C2)(C)C

Isomeric SMILES

CC1=NC2=C([C@@H](C1C(=O)OCC3=CC=C(C=C3)OC)C4=CC=NC=C4)C(=O)CC(C2)(C)C

InChI

InChI=1S/C26H28N2O4/c1-16-22(25(30)32-15-17-5-7-19(31-4)8-6-17)23(18-9-11-27-12-10-18)24-20(28-16)13-26(2,3)14-21(24)29/h5-12,22-23H,13-15H2,1-4H3/t22?,23-/m1/s1