N1-cyclopropyl-N4-[5-methoxy-2-(methylsulfonylamino)phenyl]benzene-1,4-disulfonamide

Systemtic Name: N1-cyclopropyl-N4-[5-methoxy-2-(methylsulfonylamino)phenyl]benzene-1,4-disulfonamide Openeye Name: N1-cyclopropyl-N4-[2-(methanesulfonamido)-5-methoxy-phenyl]benzene-1,4-disulfonamide CAS Name: N1-cyclopropyl-N4-[2-(methanesulfonamido)-5-methoxyphenyl]benzene-1,4-disulfonamide IUPAC Name: 1-N-cyclopropyl-4-N-[2-(methanesulfonamido)-5-methoxyphenyl]benzene-1,4-disulfonamide Traditional Name: N-cyclopropyl-N'-[2-(methanesulfonamido)-5-methoxy-phenyl]benzene-1,4-disulfonamide Formula: C17H21N3O7S3 MolecularWeight: 475.55954

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NS(=O)(=O)C)NS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)NC3CC3

Isomeric SMILES

COC1=CC(=C(C=C1)NS(=O)(=O)C)NS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)NC3CC3

InChI

InChI=1S/C17H21N3O7S3/c1-27-13-5-10-16(19-28(2,21)22)17(11-13)20-30(25,26)15-8-6-14(7-9-15)29(23,24)18-12-3-4-12/h5-12,18-20H,3-4H2,1-2H3