propyl (4S,4aS)-4-(3-methoxy-4-oxidanyl-phenyl)-2-methyl-5-oxidanylidene-4,4a,6,7-tetrahydro-3H-quinoline-3-carboxylate

Systemtic Name: propyl (4S,4aS)-4-(3-methoxy-4-oxidanyl-phenyl)-2-methyl-5-oxidanylidene-4,4a,6,7-tetrahydro-3H-quinoline-3-carboxylate Openeye Name: propyl (4S,4aS)-4-(4-hydroxy-3-methoxy-phenyl)-2-methyl-5-oxo-4,4a,6,7-tetrahydro-3H-quinoline-3-carboxylate CAS Name: (4S,4aS)-4-(4-hydroxy-3-methoxyphenyl)-2-methyl-5-oxo-4,4a,6,7-tetrahydro-3H-quinoline-3-carboxylic acid propyl ester IUPAC Name: propyl (4S,4aS)-4-(4-hydroxy-3-methoxyphenyl)-2-methyl-5-oxo-4,4a,6,7-tetrahydro-3H-quinoline-3-carboxylate Traditional Name: (4S,4aS)-4-(4-hydroxy-3-methoxy-phenyl)-5-keto-2-methyl-4,4a,6,7-tetrahydro-3H-quinoline-3-carboxylic acid propyl ester Formula: C21H25NO5 MolecularWeight: 371.4269

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1C(C2C(=O)CCC=C2N=C1C)C3=CC(=C(C=C3)O)OC

Isomeric SMILES

CCCOC(=O)C1[C@H]([C@@H]2C(=O)CCC=C2N=C1C)C3=CC(=C(C=C3)O)OC

InChI

InChI=1S/C21H25NO5/c1-4-10-27-21(25)18-12(2)22-14-6-5-7-16(24)20(14)19(18)13-8-9-15(23)17(11-13)26-3/h6,8-9,11,18-20,23H,4-5,7,10H2,1-3H3/t18?,19-,20+/m1/s1