[(2S)-butan-2-yl] (4S)-4-(4-methoxy-3-oxidanyl-phenyl)-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate

Systemtic Name: [(2S)-butan-2-yl] (4S)-4-(4-methoxy-3-oxidanyl-phenyl)-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Openeye Name: [(1S)-1-methylpropyl] (4S)-4-(3-hydroxy-4-methoxy-phenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate CAS Name: (4S)-4-(3-hydroxy-4-methoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid [(2S)-butan-2-yl] ester IUPAC Name: [(2S)-butan-2-yl] (4S)-4-(3-hydroxy-4-methoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Traditional Name: (4S)-4-(3-hydroxy-4-methoxy-phenyl)-5-keto-2-methyl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid [(1S)-1-methylpropyl] ester Formula: C22H27NO5 MolecularWeight: 385.45348

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)C1C(C2=C(CCCC2=O)N=C1C)C3=CC(=C(C=C3)OC)O

Isomeric SMILES

CC[C@H](C)OC(=O)C1[C@H](C2=C(CCCC2=O)N=C1C)C3=CC(=C(C=C3)OC)O

InChI

InChI=1S/C22H27NO5/c1-5-12(2)28-22(26)19-13(3)23-15-7-6-8-16(24)21(15)20(19)14-9-10-18(27-4)17(25)11-14/h9-12,19-20,25H,5-8H2,1-4H3/t12-,19?,20+/m0/s1