4-chloranyl-3-(3-methylpyrrolidin-1-yl)-5-sulfamoyl-benzoic acid

Systemtic Name: 4-chloranyl-3-(3-methylpyrrolidin-1-yl)-5-sulfamoyl-benzoic acid Openeye Name: 4-chloro-3-(3-methylpyrrolidin-1-yl)-5-sulfamoyl-benzoic acid CAS Name: 4-chloro-3-(3-methyl-1-pyrrolidinyl)-5-sulfamoylbenzoic acid IUPAC Name: 4-chloro-3-(3-methylpyrrolidin-1-yl)-5-sulfamoylbenzoic acid Traditional Name: 4-chloro-3-(3-methylpyrrolidino)-5-sulfamoyl-benzoic acid Formula: C12H15ClN2O4S MolecularWeight: 318.7765

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C1)C2=C(C(=CC(=C2)C(=O)O)S(=O)(=O)N)Cl

Isomeric SMILES

CC1CCN(C1)C2=C(C(=CC(=C2)C(=O)O)S(=O)(=O)N)Cl

InChI

InChI=1S/C12H15ClN2O4S/c1-7-2-3-15(6-7)9-4-8(12(16)17)5-10(11(9)13)20(14,18)19/h4-5,7H,2-3,6H2,1H3,(H,16,17)(H2,14,18,19)