(3-azanyl-1,2,4-triazol-1-yl)-(5-methyl-2-nitro-phenyl)methanone

Systemtic Name: (3-azanyl-1,2,4-triazol-1-yl)-(5-methyl-2-nitro-phenyl)methanone Openeye Name: (3-amino-1,2,4-triazol-1-yl)-(5-methyl-2-nitro-phenyl)methanone CAS Name: (3-amino-1,2,4-triazol-1-yl)-(5-methyl-2-nitrophenyl)methanone IUPAC Name: (3-amino-1,2,4-triazol-1-yl)-(5-methyl-2-nitrophenyl)methanone Traditional Name: (3-amino-1,2,4-triazol-1-yl)-(5-methyl-2-nitro-phenyl)methanone Formula: C10H9N5O3 MolecularWeight: 247.21016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)N2C=NC(=N2)N

Isomeric SMILES

CC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)N2C=NC(=N2)N

InChI

InChI=1S/C10H9N5O3/c1-6-2-3-8(15(17)18)7(4-6)9(16)14-5-12-10(11)13-14/h2-5H,1H3,(H2,11,13)