3-[(4-methylsulfonyloxypyrrolidin-2-yl)methoxy-naphthalen-2-ylsulfonyl-methyl]benzoic acid

Systemtic Name: 3-[(4-methylsulfonyloxypyrrolidin-2-yl)methoxy-naphthalen-2-ylsulfonyl-methyl]benzoic acid Openeye Name: 3-[(4-methylsulfonyloxypyrrolidin-2-yl)methoxy-(2-naphthylsulfonyl)methyl]benzoic acid CAS Name: 3-[(4-methylsulfonyloxy-2-pyrrolidinyl)methoxy-(2-naphthalenylsulfonyl)methyl]benzoic acid IUPAC Name: 3-[(4-methylsulfonyloxypyrrolidin-2-yl)methoxy-naphthalen-2-ylsulfonylmethyl]benzoic acid Traditional Name: 3-[(4-methylsulfonyloxypyrrolidin-2-yl)methoxy-(2-naphthylsulfonyl)methyl]benzoic acid Formula: C24H25NO8S2 MolecularWeight: 519.5872

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1CC(NC1)COC(C2=CC=CC(=C2)C(=O)O)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CS(=O)(=O)OC1CC(NC1)COC(C2=CC=CC(=C2)C(=O)O)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C24H25NO8S2/c1-34(28,29)33-21-13-20(25-14-21)15-32-24(19-8-4-7-18(11-19)23(26)27)35(30,31)22-10-9-16-5-2-3-6-17(16)12-22/h2-12,20-21,24-25H,13-15H2,1H3,(H,26,27)