3-[2-(methoxymethyl)pyrrolidin-1-yl]carbonyl-5-[methyl(methylsulfonyl)amino]benzoic acid

Systemtic Name: 3-[2-(methoxymethyl)pyrrolidin-1-yl]carbonyl-5-[methyl(methylsulfonyl)amino]benzoic acid Openeye Name: 3-[2-(methoxymethyl)pyrrolidine-1-carbonyl]-5-[methyl(methylsulfonyl)amino]benzoic acid CAS Name: 3-[[2-(methoxymethyl)-1-pyrrolidinyl]-oxomethyl]-5-[methyl(methylsulfonyl)amino]benzoic acid IUPAC Name: 3-[2-(methoxymethyl)pyrrolidine-1-carbonyl]-5-[methyl(methylsulfonyl)amino]benzoic acid Traditional Name: 3-[mesyl(methyl)amino]-5-[2-(methoxymethyl)pyrrolidine-1-carbonyl]benzoic acid Formula: C16H22N2O6S MolecularWeight: 370.42068

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC(=CC(=C1)C(=O)O)C(=O)N2CCCC2COC)S(=O)(=O)C

Isomeric SMILES

CN(C1=CC(=CC(=C1)C(=O)O)C(=O)N2CCCC2COC)S(=O)(=O)C

InChI

InChI=1S/C16H22N2O6S/c1-17(25(3,22)23)14-8-11(7-12(9-14)16(20)21)15(19)18-6-4-5-13(18)10-24-2/h7-9,13H,4-6,10H2,1-3H3,(H,20,21)