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

Systemtic Name: benzotriazol-1-yl-(2-methyl-3,5-dinitro-phenyl)methanone Openeye Name: benzotriazol-1-yl-(2-methyl-3,5-dinitro-phenyl)methanone CAS Name: 1-benzotriazolyl-(2-methyl-3,5-dinitrophenyl)methanone IUPAC Name: benzotriazol-1-yl-(2-methyl-3,5-dinitrophenyl)methanone Traditional Name: benzotriazol-1-yl-(2-methyl-3,5-dinitro-phenyl)methanone Formula: C14H9N5O5 MolecularWeight: 327.25176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1C(=O)N2C3=CC=CC=C3N=N2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1C(=O)N2C3=CC=CC=C3N=N2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H9N5O5/c1-8-10(6-9(18(21)22)7-13(8)19(23)24)14(20)17-12-5-3-2-4-11(12)15-16-17/h2-7H,1H3