(3-azanyl-1,2,4-triazol-1-yl)-(3-nitrophenyl)methanone

Systemtic Name: (3-azanyl-1,2,4-triazol-1-yl)-(3-nitrophenyl)methanone Openeye Name: (3-amino-1,2,4-triazol-1-yl)-(3-nitrophenyl)methanone CAS Name: (3-amino-1,2,4-triazol-1-yl)-(3-nitrophenyl)methanone IUPAC Name: (3-amino-1,2,4-triazol-1-yl)-(3-nitrophenyl)methanone Traditional Name: (3-amino-1,2,4-triazol-1-yl)-(3-nitrophenyl)methanone Formula: C9H7N5O3 MolecularWeight: 233.18358

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H7N5O3/c10-9-11-5-13(12-9)8(15)6-2-1-3-7(4-6)14(16)17/h1-5H,(H2,10,12)