[2-(benzotriazol-2-yl)-6-butan-2-yl-4-tert-butyl-phenyl] 4-dodecylbenzenesulfonate

Systemtic Name: [2-(benzotriazol-2-yl)-6-butan-2-yl-4-tert-butyl-phenyl] 4-dodecylbenzenesulfonate Openeye Name: [2-(benzotriazol-2-yl)-4-tert-butyl-6-sec-butyl-phenyl] 4-dodecylbenzenesulfonate CAS Name: 4-dodecylbenzenesulfonic acid [2-(2-benzotriazolyl)-6-butan-2-yl-4-tert-butylphenyl] ester IUPAC Name: [2-(benzotriazol-2-yl)-6-butan-2-yl-4-tert-butylphenyl] 4-dodecylbenzenesulfonate Traditional Name: 4-laurylbenzenesulfonic acid [2-(benzotriazol-2-yl)-4-tert-butyl-6-sec-butyl-phenyl] ester Formula: C38H53N3O3S MolecularWeight: 631.91072

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2N3N=C4C=CC=CC4=N3)C(C)(C)C)C(C)CC

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2N3N=C4C=CC=CC4=N3)C(C)(C)C)C(C)CC

InChI

InChI=1S/C38H53N3O3S/c1-7-9-10-11-12-13-14-15-16-17-20-30-23-25-32(26-24-30)45(42,43)44-37-33(29(3)8-2)27-31(38(4,5)6)28-36(37)41-39-34-21-18-19-22-35(34)40-41/h18-19,21-29H,7-17,20H2,1-6H3