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

Systemtic Name: 4-[(4S)-3-ethoxycarbonyl-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-3H-quinolin-4-yl]-2-nitro-phenolate Openeye Name: 4-[(4S)-3-ethoxycarbonyl-2-methyl-5-oxo-4,6,7,8-tetrahydro-3H-quinolin-4-yl]-2-nitro-phenolate CAS Name: 4-[(4S)-3-ethoxycarbonyl-2-methyl-5-oxo-4,6,7,8-tetrahydro-3H-quinolin-4-yl]-2-nitrophenolate IUPAC Name: 4-[(4S)-3-ethoxycarbonyl-2-methyl-5-oxo-4,6,7,8-tetrahydro-3H-quinolin-4-yl]-2-nitrophenolate Traditional Name: 4-[(4S)-3-carbethoxy-5-keto-2-methyl-4,6,7,8-tetrahydro-3H-quinolin-4-yl]-2-nitro-phenolate Formula: C19H19N2O6- MolecularWeight: 371.36396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C2=C(CCCC2=O)N=C1C)C3=CC(=C(C=C3)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1[C@H](C2=C(CCCC2=O)N=C1C)C3=CC(=C(C=C3)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H20N2O6/c1-3-27-19(24)16-10(2)20-12-5-4-6-15(23)18(12)17(16)11-7-8-14(22)13(9-11)21(25)26/h7-9,16-17,22H,3-6H2,1-2H3/p-1/t16?,17-/m1/s1