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

Systemtic Name: cycloheptyl (4S)-2-methyl-4-(3-nitrophenyl)-5-oxidanylidene-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Openeye Name: cycloheptyl (4S)-2-methyl-4-(3-nitrophenyl)-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate CAS Name: (4S)-2-methyl-4-(3-nitrophenyl)-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid cycloheptyl ester IUPAC Name: cycloheptyl (4S)-2-methyl-4-(3-nitrophenyl)-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Traditional Name: (4S)-5-keto-2-methyl-4-(3-nitrophenyl)-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid cycloheptyl ester Formula: C24H28N2O5 MolecularWeight: 424.48952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(C1C(=O)OC3CCCCCC3)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)CCC2

Isomeric SMILES

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

InChI

InChI=1S/C24H28N2O5/c1-15-21(24(28)31-18-10-4-2-3-5-11-18)22(16-8-6-9-17(14-16)26(29)30)23-19(25-15)12-7-13-20(23)27/h6,8-9,14,18,21-22H,2-5,7,10-13H2,1H3/t21?,22-/m1/s1