1-(benzotriazol-1-yl)-2-(4-methylphenyl)sulfonyl-ethanone

Systemtic Name: 1-(benzotriazol-1-yl)-2-(4-methylphenyl)sulfonyl-ethanone Openeye Name: 1-(benzotriazol-1-yl)-2-(p-tolylsulfonyl)ethanone CAS Name: 1-(1-benzotriazolyl)-2-(4-methylphenyl)sulfonylethanone IUPAC Name: 1-(benzotriazol-1-yl)-2-(4-methylphenyl)sulfonylethanone Traditional Name: 1-(benzotriazol-1-yl)-2-tosyl-ethanone Formula: C15H13N3O3S MolecularWeight: 315.34702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC(=O)N2C3=CC=CC=C3N=N2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC(=O)N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C15H13N3O3S/c1-11-6-8-12(9-7-11)22(20,21)10-15(19)18-14-5-3-2-4-13(14)16-17-18/h2-9H,10H2,1H3