N-[4-[(5-nitro-4-oxidanylidene-1H-pyrimidin-6-yl)amino]phenyl]ethanamide

Systemtic Name: N-[4-[(5-nitro-4-oxidanylidene-1H-pyrimidin-6-yl)amino]phenyl]ethanamide Openeye Name: N-[4-[(5-nitro-4-oxo-1H-pyrimidin-6-yl)amino]phenyl]acetamide CAS Name: N-[4-[(5-nitro-4-oxo-1H-pyrimidin-6-yl)amino]phenyl]acetamide IUPAC Name: N-[4-[(5-nitro-4-oxo-1H-pyrimidin-6-yl)amino]phenyl]acetamide Traditional Name: N-[4-[(4-keto-5-nitro-1H-pyrimidin-6-yl)amino]phenyl]acetamide Formula: C12H11N5O4 MolecularWeight: 289.24684

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC2=C(C(=O)N=CN2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC2=C(C(=O)N=CN2)[N+](=O)[O-]

InChI

InChI=1S/C12H11N5O4/c1-7(18)15-8-2-4-9(5-3-8)16-11-10(17(20)21)12(19)14-6-13-11/h2-6H,1H3,(H,15,18)(H2,13,14,16,19)