phenethyl (4S)-2-methyl-5-oxidanylidene-4-pyridin-2-yl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate

Systemtic Name: phenethyl (4S)-2-methyl-5-oxidanylidene-4-pyridin-2-yl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Openeye Name: phenethyl (4S)-2-methyl-5-oxo-4-(2-pyridyl)-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate CAS Name: (4S)-2-methyl-5-oxo-4-(2-pyridinyl)-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid phenethyl ester IUPAC Name: phenethyl (4S)-2-methyl-5-oxo-4-pyridin-2-yl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Traditional Name: (4S)-5-keto-2-methyl-4-(2-pyridyl)-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid phenethyl ester Formula: C24H24N2O3 MolecularWeight: 388.45896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(C1C(=O)OCCC3=CC=CC=C3)C4=CC=CC=N4)C(=O)CCC2

Isomeric SMILES

CC1=NC2=C([C@H](C1C(=O)OCCC3=CC=CC=C3)C4=CC=CC=N4)C(=O)CCC2

InChI

InChI=1S/C24H24N2O3/c1-16-21(24(28)29-15-13-17-8-3-2-4-9-17)23(18-10-5-6-14-25-18)22-19(26-16)11-7-12-20(22)27/h2-6,8-10,14,21,23H,7,11-13,15H2,1H3/t21?,23-/m0/s1