2-phenoxyethyl (3R,4R)-2-methyl-4-(4-methylphenyl)-5-oxidanylidene-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate

Systemtic Name: 2-phenoxyethyl (3R,4R)-2-methyl-4-(4-methylphenyl)-5-oxidanylidene-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Openeye Name: 2-phenoxyethyl (3R,4R)-2-methyl-5-oxo-4-(p-tolyl)-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate CAS Name: (3R,4R)-2-methyl-4-(4-methylphenyl)-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl (3R,4R)-2-methyl-4-(4-methylphenyl)-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Traditional Name: (3R,4R)-5-keto-2-methyl-4-(p-tolyl)-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid 2-phenoxyethyl ester Formula: C26H27NO4 MolecularWeight: 417.49688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(C(=NC3=C2C(=O)CCC3)C)C(=O)OCCOC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)[C@H]2[C@H](C(=NC3=C2C(=O)CCC3)C)C(=O)OCCOC4=CC=CC=C4

InChI

InChI=1S/C26H27NO4/c1-17-11-13-19(14-12-17)24-23(18(2)27-21-9-6-10-22(28)25(21)24)26(29)31-16-15-30-20-7-4-3-5-8-20/h3-5,7-8,11-14,23-24H,6,9-10,15-16H2,1-2H3/t23-,24-/m0/s1