ethyl 3-chloranyl-5-[(3-dodecoxycarbonylphenoxy)sulfinylamino]-2-oxidanyl-benzoate

Systemtic Name: ethyl 3-chloranyl-5-[(3-dodecoxycarbonylphenoxy)sulfinylamino]-2-oxidanyl-benzoate Openeye Name: ethyl 3-chloro-5-[(3-dodecoxycarbonylphenoxy)sulfinylamino]-2-hydroxy-benzoate CAS Name: 3-chloro-5-[[3-[dodecoxy(oxo)methyl]phenoxy]sulfinylamino]-2-hydroxybenzoic acid ethyl ester IUPAC Name: ethyl 3-chloro-5-[(3-dodecoxycarbonylphenoxy)sulfinylamino]-2-hydroxybenzoate Traditional Name: 3-chloro-2-hydroxy-5-[(3-lauryloxycarbonylphenoxy)sulfinylamino]benzoic acid ethyl ester Formula: C28H38ClNO7S MolecularWeight: 568.12182

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C1=CC(=CC=C1)OS(=O)NC2=CC(=C(C(=C2)C(=O)OCC)O)Cl

Isomeric SMILES

CCCCCCCCCCCCOC(=O)C1=CC(=CC=C1)OS(=O)NC2=CC(=C(C(=C2)C(=O)OCC)O)Cl

InChI

InChI=1S/C28H38ClNO7S/c1-3-5-6-7-8-9-10-11-12-13-17-36-27(32)21-15-14-16-23(18-21)37-38(34)30-22-19-24(28(33)35-4-2)26(31)25(29)20-22/h14-16,18-20,30-31H,3-13,17H2,1-2H3