2-(benzotriazol-1-yl)-1-(4-methyl-3-nitro-phenyl)ethanone

Systemtic Name: 2-(benzotriazol-1-yl)-1-(4-methyl-3-nitro-phenyl)ethanone Openeye Name: 2-(benzotriazol-1-yl)-1-(4-methyl-3-nitro-phenyl)ethanone CAS Name: 2-(1-benzotriazolyl)-1-(4-methyl-3-nitrophenyl)ethanone IUPAC Name: 2-(benzotriazol-1-yl)-1-(4-methyl-3-nitrophenyl)ethanone Traditional Name: 2-(benzotriazol-1-yl)-1-(4-methyl-3-nitro-phenyl)ethanone Formula: C15H12N4O3 MolecularWeight: 296.28078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)CN2C3=CC=CC=C3N=N2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)CN2C3=CC=CC=C3N=N2)[N+](=O)[O-]

InChI

InChI=1S/C15H12N4O3/c1-10-6-7-11(8-14(10)19(21)22)15(20)9-18-13-5-3-2-4-12(13)16-17-18/h2-8H,9H2,1H3