[4-[(4-hydroxyphenyl)carbamoyl]phenyl] nonane-1-sulfonate

Systemtic Name: [4-[(4-hydroxyphenyl)carbamoyl]phenyl] nonane-1-sulfonate Openeye Name: [4-[(4-hydroxyphenyl)carbamoyl]phenyl] nonane-1-sulfonate CAS Name: 1-nonanesulfonic acid IUPAC Name: [4-[(4-hydroxyphenyl)carbamoyl]phenyl] nonane-1-sulfonate Traditional Name: nonane-1-sulfonic acid [4-[(4-hydroxyphenyl)carbamoyl]phenyl] ester Formula: C22H29NO5S MolecularWeight: 419.53436

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCS(=O)(=O)OC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)O

Isomeric SMILES

CCCCCCCCCS(=O)(=O)OC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)O

InChI

InChI=1S/C22H29NO5S/c1-2-3-4-5-6-7-8-17-29(26,27)28-21-15-9-18(10-16-21)22(25)23-19-11-13-20(24)14-12-19/h9-16,24H,2-8,17H2,1H3,(H,23,25)