4-[(4S)-3-methoxycarbonyl-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-3H-quinolin-4-yl]-2-nitro-phenolate

Systemtic Name: 4-[(4S)-3-methoxycarbonyl-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-3H-quinolin-4-yl]-2-nitro-phenolate Openeye Name: 4-[(4S)-3-methoxycarbonyl-2-methyl-5-oxo-4,6,7,8-tetrahydro-3H-quinolin-4-yl]-2-nitro-phenolate CAS Name: 4-[(4S)-3-methoxycarbonyl-2-methyl-5-oxo-4,6,7,8-tetrahydro-3H-quinolin-4-yl]-2-nitrophenolate IUPAC Name: 4-[(4S)-3-methoxycarbonyl-2-methyl-5-oxo-4,6,7,8-tetrahydro-3H-quinolin-4-yl]-2-nitrophenolate Traditional Name: 4-[(4S)-3-carbomethoxy-5-keto-2-methyl-4,6,7,8-tetrahydro-3H-quinolin-4-yl]-2-nitro-phenolate Formula: C18H17N2O6- MolecularWeight: 357.33738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(C1C(=O)OC)C3=CC(=C(C=C3)[O-])[N+](=O)[O-])C(=O)CCC2

Isomeric SMILES

CC1=NC2=C([C@@H](C1C(=O)OC)C3=CC(=C(C=C3)[O-])[N+](=O)[O-])C(=O)CCC2

InChI

InChI=1S/C18H18N2O6/c1-9-15(18(23)26-2)16(17-11(19-9)4-3-5-14(17)22)10-6-7-13(21)12(8-10)20(24)25/h6-8,15-16,21H,3-5H2,1-2H3/p-1/t15?,16-/m1/s1