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

Systemtic Name: 3-[(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)sulfamoyl]-4-methoxy-benzoic acid Openeye Name: 3-[[4-chloro-3-(1-piperidylsulfonyl)phenyl]sulfamoyl]-4-methoxy-benzoic acid CAS Name: 3-[[4-chloro-3-(1-piperidinylsulfonyl)phenyl]sulfamoyl]-4-methoxybenzoic acid IUPAC Name: 3-[(4-chloro-3-piperidin-1-ylsulfonylphenyl)sulfamoyl]-4-methoxybenzoic acid Traditional Name: 3-[(4-chloro-3-piperidinosulfonyl-phenyl)sulfamoyl]-4-methoxy-benzoic acid Formula: C19H21ClN2O7S2 MolecularWeight: 488.96224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21ClN2O7S2/c1-29-16-8-5-13(19(23)24)11-18(16)30(25,26)21-14-6-7-15(20)17(12-14)31(27,28)22-9-3-2-4-10-22/h5-8,11-12,21H,2-4,9-10H2,1H3,(H,23,24)