7-azanyl-5-(4-chloranyl-2-nitro-phenyl)-4-oxidanylidene-3,5-dihydropyrano[2,3-d]pyrimidine-6-carbonitrile

Systemtic Name: 7-azanyl-5-(4-chloranyl-2-nitro-phenyl)-4-oxidanylidene-3,5-dihydropyrano[2,3-d]pyrimidine-6-carbonitrile Openeye Name: 7-amino-5-(4-chloro-2-nitro-phenyl)-4-oxo-3,5-dihydropyrano[2,3-d]pyrimidine-6-carbonitrile CAS Name: 7-amino-5-(4-chloro-2-nitrophenyl)-4-oxo-3,5-dihydropyrano[2,3-d]pyrimidine-6-carbonitrile IUPAC Name: 7-amino-5-(4-chloro-2-nitrophenyl)-4-oxo-3,5-dihydropyrano[2,3-d]pyrimidine-6-carbonitrile Traditional Name: 7-amino-5-(4-chloro-2-nitro-phenyl)-4-keto-3,5-dihydropyrano[2,3-d]pyrimidine-6-carbonitrile Formula: C14H8ClN5O4 MolecularWeight: 345.69742

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)[N+](=O)[O-])C2C(=C(OC3=C2C(=O)NC=N3)N)C#N

Isomeric SMILES

C1=CC(=C(C=C1Cl)[N+](=O)[O-])C2C(=C(OC3=C2C(=O)NC=N3)N)C#N

InChI

InChI=1S/C14H8ClN5O4/c15-6-1-2-7(9(3-6)20(22)23)10-8(4-16)12(17)24-14-11(10)13(21)18-5-19-14/h1-3,5,10H,17H2,(H,18,19,21)