N3-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]benzene-1,3-disulfonamide

Systemtic Name: N3-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]benzene-1,3-disulfonamide Openeye Name: N3-[4-[(2-methoxy-1-methyl-ethyl)sulfamoyl]phenyl]benzene-1,3-disulfonamide CAS Name: N3-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]benzene-1,3-disulfonamide IUPAC Name: 3-N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]benzene-1,3-disulfonamide Traditional Name: N'-[4-[(2-methoxy-1-methyl-ethyl)sulfamoyl]phenyl]benzene-1,3-disulfonamide Formula: C16H21N3O7S3 MolecularWeight: 463.54884

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)NS(=O)(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)S(=O)(=O)N

Isomeric SMILES

CC(COC)NS(=O)(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)S(=O)(=O)N

InChI

InChI=1S/C16H21N3O7S3/c1-12(11-26-2)18-28(22,23)14-8-6-13(7-9-14)19-29(24,25)16-5-3-4-15(10-16)27(17,20)21/h3-10,12,18-19H,11H2,1-2H3,(H2,17,20,21)