4-[(4S)-2-azanyl-3-cyano-6-methyl-5-oxidanylidene-4H-pyrano[3,2-c]quinolin-4-yl]-2-methoxy-6-nitro-phenolate

Systemtic Name: 4-[(4S)-2-azanyl-3-cyano-6-methyl-5-oxidanylidene-4H-pyrano[3,2-c]quinolin-4-yl]-2-methoxy-6-nitro-phenolate Openeye Name: 4-[(4S)-2-amino-3-cyano-6-methyl-5-oxo-4H-pyrano[3,2-c]quinolin-4-yl]-2-methoxy-6-nitro-phenolate CAS Name: 4-[(4S)-2-amino-3-cyano-6-methyl-5-oxo-4H-pyrano[3,2-c]quinolin-4-yl]-2-methoxy-6-nitrophenolate IUPAC Name: 4-[(4S)-2-amino-3-cyano-6-methyl-5-oxo-4H-pyrano[3,2-c]quinolin-4-yl]-2-methoxy-6-nitrophenolate Traditional Name: 4-[(4S)-2-amino-3-cyano-5-keto-6-methyl-4H-pyrano[3,2-c]quinolin-4-yl]-2-methoxy-6-nitro-phenolate Formula: C21H15N4O6- MolecularWeight: 419.367

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C3=C(C1=O)C(C(=C(O3)N)C#N)C4=CC(=C(C(=C4)OC)[O-])[N+](=O)[O-]

Isomeric SMILES

CN1C2=CC=CC=C2C3=C(C1=O)[C@H](C(=C(O3)N)C#N)C4=CC(=C(C(=C4)OC)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H16N4O6/c1-24-13-6-4-3-5-11(13)19-17(21(24)27)16(12(9-22)20(23)31-19)10-7-14(25(28)29)18(26)15(8-10)30-2/h3-8,16,26H,23H2,1-2H3/p-1/t16-/m0/s1