2-[2-(benzotriazol-2-yl)-6-prop-2-enyl-4-(2,4,4-trimethylpentan-2-yl)phenyl]benzenesulfonate

Systemtic Name: 2-[2-(benzotriazol-2-yl)-6-prop-2-enyl-4-(2,4,4-trimethylpentan-2-yl)phenyl]benzenesulfonate Openeye Name: 2-[2-allyl-6-(benzotriazol-2-yl)-4-(1,1,3,3-tetramethylbutyl)phenyl]benzenesulfonate CAS Name: 2-[2-(2-benzotriazolyl)-6-prop-2-enyl-4-(2,4,4-trimethylpentan-2-yl)phenyl]benzenesulfonate IUPAC Name: 2-[2-(benzotriazol-2-yl)-6-prop-2-enyl-4-(2,4,4-trimethylpentan-2-yl)phenyl]benzenesulfonate Traditional Name: 2-[2-allyl-6-(benzotriazol-2-yl)-4-(1,1,3,3-tetramethylbutyl)phenyl]besylate Formula: C29H32N3O3S- MolecularWeight: 502.64768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)C1=CC(=C(C(=C1)N2N=C3C=CC=CC3=N2)C4=CC=CC=C4S(=O)(=O)[O-])CC=C

Isomeric SMILES

CC(C)(C)CC(C)(C)C1=CC(=C(C(=C1)N2N=C3C=CC=CC3=N2)C4=CC=CC=C4S(=O)(=O)[O-])CC=C

InChI

InChI=1S/C29H33N3O3S/c1-7-12-20-17-21(29(5,6)19-28(2,3)4)18-25(32-30-23-14-9-10-15-24(23)31-32)27(20)22-13-8-11-16-26(22)36(33,34)35/h7-11,13-18H,1,12,19H2,2-6H3,(H,33,34,35)/p-1