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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(C1C(=O)OCCC3=CC=CC=C3)C4=CC(=CC=C4)OC)C(=O)CCC2

Isomeric SMILES

CC1=NC2=C([C@H](C1C(=O)OCCC3=CC=CC=C3)C4=CC(=CC=C4)OC)C(=O)CCC2

InChI

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