[4-[(4-hydroxyphenyl)carbonylamino]phenyl] dodecane-1-sulfonate

Systemtic Name: [4-[(4-hydroxyphenyl)carbonylamino]phenyl] dodecane-1-sulfonate Openeye Name: [4-[(4-hydroxybenzoyl)amino]phenyl] dodecane-1-sulfonate CAS Name: 1-dodecanesulfonic acid IUPAC Name: [4-[(4-hydroxybenzoyl)amino]phenyl] dodecane-1-sulfonate Traditional Name: dodecane-1-sulfonic acid [4-[(4-hydroxybenzoyl)amino]phenyl] ester Formula: C25H35NO5S MolecularWeight: 461.6141

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCS(=O)(=O)OC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)O

Isomeric SMILES

CCCCCCCCCCCCS(=O)(=O)OC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)O

InChI

InChI=1S/C25H35NO5S/c1-2-3-4-5-6-7-8-9-10-11-20-32(29,30)31-24-18-14-22(15-19-24)26-25(28)21-12-16-23(27)17-13-21/h12-19,27H,2-11,20H2,1H3,(H,26,28)