3-[(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)sulfamoyl]benzoic acid

Systemtic Name: 3-[(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)sulfamoyl]benzoic acid Openeye Name: 3-[[2-methoxy-5-(1-piperidylsulfonyl)phenyl]sulfamoyl]benzoic acid CAS Name: 3-[[2-methoxy-5-(1-piperidinylsulfonyl)phenyl]sulfamoyl]benzoic acid IUPAC Name: 3-[(2-methoxy-5-piperidin-1-ylsulfonylphenyl)sulfamoyl]benzoic acid Traditional Name: 3-[(2-methoxy-5-piperidinosulfonyl-phenyl)sulfamoyl]benzoic acid Formula: C19H22N2O7S2 MolecularWeight: 454.51718

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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