(5S)-7-azanyl-6-cyano-5-(4-nitrophenyl)-4-oxidanylidene-3,5-dihydropyrano[2,3-d]pyrimidin-2-olate

Systemtic Name: (5S)-7-azanyl-6-cyano-5-(4-nitrophenyl)-4-oxidanylidene-3,5-dihydropyrano[2,3-d]pyrimidin-2-olate Openeye Name: (5S)-7-amino-6-cyano-5-(4-nitrophenyl)-4-oxo-3,5-dihydropyrano[2,3-d]pyrimidin-2-olate CAS Name: (5S)-7-amino-6-cyano-5-(4-nitrophenyl)-4-oxo-3,5-dihydropyrano[2,3-d]pyrimidin-2-olate IUPAC Name: (5S)-7-amino-6-cyano-5-(4-nitrophenyl)-4-oxo-3,5-dihydropyrano[2,3-d]pyrimidin-2-olate Traditional Name: (5S)-7-amino-6-cyano-4-keto-5-(4-nitrophenyl)-3,5-dihydropyrano[2,3-d]pyrimidin-2-olate Formula: C14H8N5O5- MolecularWeight: 326.24382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2C(=C(OC3=C2C(=O)NC(=N3)[O-])N)C#N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1[C@H]2C(=C(OC3=C2C(=O)NC(=N3)[O-])N)C#N)[N+](=O)[O-]

InChI

InChI=1S/C14H9N5O5/c15-5-8-9(6-1-3-7(4-2-6)19(22)23)10-12(20)17-14(21)18-13(10)24-11(8)16/h1-4,9H,16H2,(H2,17,18,20,21)/p-1/t9-/m0/s1