4-[(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)sulfamoyl]benzoic acid

Systemtic Name: 4-[(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)sulfamoyl]benzoic acid Openeye Name: 4-[[4-ethoxy-3-(1-piperidylsulfonyl)phenyl]sulfamoyl]benzoic acid CAS Name: 4-[[4-ethoxy-3-(1-piperidinylsulfonyl)phenyl]sulfamoyl]benzoic acid IUPAC Name: 4-[(4-ethoxy-3-piperidin-1-ylsulfonylphenyl)sulfamoyl]benzoic acid Traditional Name: 4-[(4-ethoxy-3-piperidinosulfonyl-phenyl)sulfamoyl]benzoic acid Formula: C20H24N2O7S2 MolecularWeight: 468.54376

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)O)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)O)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H24N2O7S2/c1-2-29-18-11-8-16(14-19(18)31(27,28)22-12-4-3-5-13-22)21-30(25,26)17-9-6-15(7-10-17)20(23)24/h6-11,14,21H,2-5,12-13H2,1H3,(H,23,24)