2-chloranyl-4-ethylsulfonyl-5-(2-methyl-3H-pyrazol-1-yl)-3-(2-oxidanylidene-2-pyrrolidin-1-yl-ethoxy)benzoic acid

Systemtic Name: 2-chloranyl-4-ethylsulfonyl-5-(2-methyl-3H-pyrazol-1-yl)-3-(2-oxidanylidene-2-pyrrolidin-1-yl-ethoxy)benzoic acid Openeye Name: 2-chloro-4-ethylsulfonyl-5-(2-methyl-3H-pyrazol-1-yl)-3-(2-oxo-2-pyrrolidin-1-yl-ethoxy)benzoic acid CAS Name: 2-chloro-4-ethylsulfonyl-5-(2-methyl-3H-pyrazol-1-yl)-3-[2-oxo-2-(1-pyrrolidinyl)ethoxy]benzoic acid IUPAC Name: 2-chloro-4-ethylsulfonyl-5-(2-methyl-3H-pyrazol-1-yl)-3-(2-oxo-2-pyrrolidin-1-ylethoxy)benzoic acid Traditional Name: 2-chloro-4-esyl-3-(2-keto-2-pyrrolidino-ethoxy)-5-(2-methyl-3-pyrazolin-1-yl)benzoic acid Formula: C19H24ClN3O6S MolecularWeight: 457.92836

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=C(C=C(C(=C1OCC(=O)N2CCCC2)Cl)C(=O)O)N3C=CCN3C

Isomeric SMILES

CCS(=O)(=O)C1=C(C=C(C(=C1OCC(=O)N2CCCC2)Cl)C(=O)O)N3C=CCN3C

InChI

InChI=1S/C19H24ClN3O6S/c1-3-30(27,28)18-14(23-10-6-7-21(23)2)11-13(19(25)26)16(20)17(18)29-12-15(24)22-8-4-5-9-22/h6,10-11H,3-5,7-9,12H2,1-2H3,(H,25,26)