N3-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]benzene-1,3-disulfonamide

Systemtic Name: N3-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]benzene-1,3-disulfonamide Openeye Name: N3-[1-(4-methoxyphenyl)sulfonyl-4-piperidyl]benzene-1,3-disulfonamide CAS Name: N3-[1-(4-methoxyphenyl)sulfonyl-4-piperidinyl]benzene-1,3-disulfonamide IUPAC Name: 3-N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]benzene-1,3-disulfonamide Traditional Name: N'-[1-(4-methoxyphenyl)sulfonyl-4-piperidyl]benzene-1,3-disulfonamide Formula: C18H23N3O7S3 MolecularWeight: 489.58612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NS(=O)(=O)C3=CC=CC(=C3)S(=O)(=O)N

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NS(=O)(=O)C3=CC=CC(=C3)S(=O)(=O)N

InChI

InChI=1S/C18H23N3O7S3/c1-28-15-5-7-16(8-6-15)31(26,27)21-11-9-14(10-12-21)20-30(24,25)18-4-2-3-17(13-18)29(19,22)23/h2-8,13-14,20H,9-12H2,1H3,(H2,19,22,23)