cycloheptyl (4S)-4-(2,3-dimethoxyphenyl)-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate

Systemtic Name: cycloheptyl (4S)-4-(2,3-dimethoxyphenyl)-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Openeye Name: cycloheptyl (4S)-4-(2,3-dimethoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate CAS Name: (4S)-4-(2,3-dimethoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid cycloheptyl ester IUPAC Name: cycloheptyl (4S)-4-(2,3-dimethoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Traditional Name: (4S)-4-(2,3-dimethoxyphenyl)-5-keto-2-methyl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid cycloheptyl ester Formula: C26H33NO5 MolecularWeight: 439.54392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(C1C(=O)OC3CCCCCC3)C4=C(C(=CC=C4)OC)OC)C(=O)CCC2

Isomeric SMILES

CC1=NC2=C([C@@H](C1C(=O)OC3CCCCCC3)C4=C(C(=CC=C4)OC)OC)C(=O)CCC2

InChI

InChI=1S/C26H33NO5/c1-16-22(26(29)32-17-10-6-4-5-7-11-17)23(24-19(27-16)13-9-14-20(24)28)18-12-8-15-21(30-2)25(18)31-3/h8,12,15,17,22-23H,4-7,9-11,13-14H2,1-3H3/t22?,23-/m1/s1