N-(3-chloranyl-5-methoxy-4-oxidanyl-phenyl)-8-(dodecylsulfonylamino)naphthalene-1-sulfonamide

Systemtic Name: N-(3-chloranyl-5-methoxy-4-oxidanyl-phenyl)-8-(dodecylsulfonylamino)naphthalene-1-sulfonamide Openeye Name: N-(3-chloro-4-hydroxy-5-methoxy-phenyl)-8-(dodecylsulfonylamino)naphthalene-1-sulfonamide CAS Name: N-(3-chloro-4-hydroxy-5-methoxyphenyl)-8-(dodecylsulfonylamino)-1-naphthalenesulfonamide IUPAC Name: N-(3-chloro-4-hydroxy-5-methoxyphenyl)-8-(dodecylsulfonylamino)naphthalene-1-sulfonamide Traditional Name: N-(3-chloro-4-hydroxy-5-methoxy-phenyl)-8-(laurylsulfonylamino)naphthalene-1-sulfonamide Formula: C29H39ClN2O6S2 MolecularWeight: 611.21276

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCS(=O)(=O)NC1=CC=CC2=C1C(=CC=C2)S(=O)(=O)NC3=CC(=C(C(=C3)Cl)O)OC

Isomeric SMILES

CCCCCCCCCCCCS(=O)(=O)NC1=CC=CC2=C1C(=CC=C2)S(=O)(=O)NC3=CC(=C(C(=C3)Cl)O)OC

InChI

InChI=1S/C29H39ClN2O6S2/c1-3-4-5-6-7-8-9-10-11-12-19-39(34,35)32-25-17-13-15-22-16-14-18-27(28(22)25)40(36,37)31-23-20-24(30)29(33)26(21-23)38-2/h13-18,20-21,31-33H,3-12,19H2,1-2H3