(2-azanyl-3,5-dinitro-phenyl)-(benzotriazol-1-yl)methanone

Systemtic Name: (2-azanyl-3,5-dinitro-phenyl)-(benzotriazol-1-yl)methanone Openeye Name: (2-amino-3,5-dinitro-phenyl)-(benzotriazol-1-yl)methanone CAS Name: (2-amino-3,5-dinitrophenyl)-(1-benzotriazolyl)methanone IUPAC Name: (2-amino-3,5-dinitrophenyl)-(benzotriazol-1-yl)methanone Traditional Name: (2-amino-3,5-dinitro-phenyl)-(benzotriazol-1-yl)methanone Formula: C13H8N6O5 MolecularWeight: 328.23982

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2C(=O)C3=CC(=CC(=C3N)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2C(=O)C3=CC(=CC(=C3N)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H8N6O5/c14-12-8(5-7(18(21)22)6-11(12)19(23)24)13(20)17-10-4-2-1-3-9(10)15-16-17/h1-6H,14H2