(4-hexoxyphenyl) 4-acetamidobenzenesulfonate

Systemtic Name: (4-hexoxyphenyl) 4-acetamidobenzenesulfonate Openeye Name: (4-hexoxyphenyl) 4-acetamidobenzenesulfonate CAS Name: 4-acetamidobenzenesulfonic acid (4-hexoxyphenyl) ester IUPAC Name: (4-hexoxyphenyl) 4-acetamidobenzenesulfonate Traditional Name: 4-acetamidobenzenesulfonic acid (4-hexoxyphenyl) ester Formula: C20H25NO5S MolecularWeight: 391.4812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C20H25NO5S/c1-3-4-5-6-15-25-18-9-11-19(12-10-18)26-27(23,24)20-13-7-17(8-14-20)21-16(2)22/h7-14H,3-6,15H2,1-2H3,(H,21,22)