methyl (4S)-2-methyl-4-(3-nitrophenyl)-5-oxidanylidene-3,4-dihydroindeno[1,2-b]pyridine-3-carboxylate

Systemtic Name: methyl (4S)-2-methyl-4-(3-nitrophenyl)-5-oxidanylidene-3,4-dihydroindeno[1,2-b]pyridine-3-carboxylate Openeye Name: methyl (4S)-2-methyl-4-(3-nitrophenyl)-5-oxo-3,4-dihydroindeno[1,2-b]pyridine-3-carboxylate CAS Name: (4S)-2-methyl-4-(3-nitrophenyl)-5-oxo-3,4-dihydroindeno[1,2-b]pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl (4S)-2-methyl-4-(3-nitrophenyl)-5-oxo-3,4-dihydroindeno[1,2-b]pyridine-3-carboxylate Traditional Name: (4S)-5-keto-2-methyl-4-(3-nitrophenyl)-3,4-dihydroindeno[1,2-b]pyridine-3-carboxylic acid methyl ester Formula: C21H16N2O5 MolecularWeight: 376.36214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(C1C(=O)OC)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)C4=CC=CC=C42

Isomeric SMILES

CC1=NC2=C([C@@H](C1C(=O)OC)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)C4=CC=CC=C42

InChI

InChI=1S/C21H16N2O5/c1-11-16(21(25)28-2)17(12-6-5-7-13(10-12)23(26)27)18-19(22-11)14-8-3-4-9-15(14)20(18)24/h3-10,16-17H,1-2H3/t16?,17-/m1/s1