3-[[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[[5-(p-tolyl)-1,2,4-oxadiazol-3-yl]methyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[[5-(p-tolyl)-1,2,4-oxadiazol-3-yl]methyl]-1,2,3-benzotriazin-4-one Formula: C17H13N5O2 MolecularWeight: 319.31742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NO2)CN3C(=O)C4=CC=CC=C4N=N3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NO2)CN3C(=O)C4=CC=CC=C4N=N3

InChI

InChI=1S/C17H13N5O2/c1-11-6-8-12(9-7-11)16-18-15(20-24-16)10-22-17(23)13-4-2-3-5-14(13)19-21-22/h2-9H,10H2,1H3