2-(2-azanyl-5-nitro-pyrimidin-4-yl)oxy-4-cyano-benzamide

Systemtic Name: 2-(2-azanyl-5-nitro-pyrimidin-4-yl)oxy-4-cyano-benzamide Openeye Name: 2-(2-amino-5-nitro-pyrimidin-4-yl)oxy-4-cyano-benzamide CAS Name: 2-[(2-amino-5-nitro-4-pyrimidinyl)oxy]-4-cyanobenzamide IUPAC Name: 2-(2-amino-5-nitropyrimidin-4-yl)oxy-4-cyanobenzamide Traditional Name: 2-(2-amino-5-nitro-pyrimidin-4-yl)oxy-4-cyano-benzamide Formula: C12H8N6O4 MolecularWeight: 300.22972

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C#N)OC2=NC(=NC=C2[N+](=O)[O-])N)C(=O)N

Isomeric SMILES

C1=CC(=C(C=C1C#N)OC2=NC(=NC=C2[N+](=O)[O-])N)C(=O)N

InChI

InChI=1S/C12H8N6O4/c13-4-6-1-2-7(10(14)19)9(3-6)22-11-8(18(20)21)5-16-12(15)17-11/h1-3,5H,(H2,14,19)(H2,15,16,17)