4-methoxy-3-[(3-piperidin-1-ylsulfonylphenyl)sulfamoyl]benzoic acid

Systemtic Name: 4-methoxy-3-[(3-piperidin-1-ylsulfonylphenyl)sulfamoyl]benzoic acid Openeye Name: 4-methoxy-3-[[3-(1-piperidylsulfonyl)phenyl]sulfamoyl]benzoic acid CAS Name: 4-methoxy-3-[[3-(1-piperidinylsulfonyl)phenyl]sulfamoyl]benzoic acid IUPAC Name: 4-methoxy-3-[(3-piperidin-1-ylsulfonylphenyl)sulfamoyl]benzoic acid Traditional Name: 4-methoxy-3-[(3-piperidinosulfonylphenyl)sulfamoyl]benzoic acid Formula: C19H22N2O7S2 MolecularWeight: 454.51718

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

InChI

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