[4-[5-[(4-tert-butylphenyl)methyl]-5-oxidanyl-undecyl]phenyl] sulfamate

Systemtic Name: [4-[5-[(4-tert-butylphenyl)methyl]-5-oxidanyl-undecyl]phenyl] sulfamate Openeye Name: [4-[5-[(4-tert-butylphenyl)methyl]-5-hydroxy-undecyl]phenyl] sulfamate CAS Name: sulfamic acid [4-[5-[(4-tert-butylphenyl)methyl]-5-hydroxyundecyl]phenyl] ester IUPAC Name: [4-[5-[(4-tert-butylphenyl)methyl]-5-hydroxyundecyl]phenyl] sulfamate Traditional Name: sulfamic acid [4-[5-(4-tert-butylbenzyl)-5-hydroxy-undecyl]phenyl] ester Formula: C28H43NO4S MolecularWeight: 489.71032

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCCCC1=CC=C(C=C1)OS(=O)(=O)N)(CC2=CC=C(C=C2)C(C)(C)C)O

Isomeric SMILES

CCCCCCC(CCCCC1=CC=C(C=C1)OS(=O)(=O)N)(CC2=CC=C(C=C2)C(C)(C)C)O

InChI

InChI=1S/C28H43NO4S/c1-5-6-7-9-20-28(30,22-24-12-16-25(17-13-24)27(2,3)4)21-10-8-11-23-14-18-26(19-15-23)33-34(29,31)32/h12-19,30H,5-11,20-22H2,1-4H3,(H2,29,31,32)