4-[(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)sulfamoyl]benzoic acid

Systemtic Name: 4-[(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)sulfamoyl]benzoic acid Openeye Name: 4-[[2-methoxy-5-(1-piperidylsulfonyl)phenyl]sulfamoyl]benzoic acid CAS Name: 4-[[2-methoxy-5-(1-piperidinylsulfonyl)phenyl]sulfamoyl]benzoic acid IUPAC Name: 4-[(2-methoxy-5-piperidin-1-ylsulfonylphenyl)sulfamoyl]benzoic acid Traditional Name: 4-[(2-methoxy-5-piperidinosulfonyl-phenyl)sulfamoyl]benzoic acid Formula: C19H22N2O7S2 MolecularWeight: 454.51718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NS(=O)(=O)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NS(=O)(=O)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C19H22N2O7S2/c1-28-18-10-9-16(30(26,27)21-11-3-2-4-12-21)13-17(18)20-29(24,25)15-7-5-14(6-8-15)19(22)23/h5-10,13,20H,2-4,11-12H2,1H3,(H,22,23)