1-[(E)-3-methyl-3-(phenylsulfonyl)but-1-enyl]benzotriazole

Systemtic Name: 1-[(E)-3-methyl-3-(phenylsulfonyl)but-1-enyl]benzotriazole Openeye Name: 1-[(E)-3-(benzenesulfonyl)-3-methyl-but-1-enyl]benzotriazole CAS Name: 1-[(E)-3-(benzenesulfonyl)-3-methylbut-1-enyl]benzotriazole IUPAC Name: 1-[(E)-3-(benzenesulfonyl)-3-methylbut-1-enyl]benzotriazole Traditional Name: 1-[(E)-3-besyl-3-methyl-but-1-enyl]benzotriazole Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C=CN1C2=CC=CC=C2N=N1)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(/C=C/N1C2=CC=CC=C2N=N1)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H17N3O2S/c1-17(2,23(21,22)14-8-4-3-5-9-14)12-13-20-16-11-7-6-10-15(16)18-19-20/h3-13H,1-2H3/b13-12+