methyl 5-[[[(2R)-1-(2-fluorophenyl)sulfonylpyrrolidin-2-yl]carbonylamino]methyl]-2-methoxy-benzoate

Systemtic Name: methyl 5-[[[(2R)-1-(2-fluorophenyl)sulfonylpyrrolidin-2-yl]carbonylamino]methyl]-2-methoxy-benzoate Openeye Name: methyl 5-[[[(2R)-1-(2-fluorophenyl)sulfonylpyrrolidine-2-carbonyl]amino]methyl]-2-methoxy-benzoate CAS Name: 5-[[[[(2R)-1-(2-fluorophenyl)sulfonyl-2-pyrrolidinyl]-oxomethyl]amino]methyl]-2-methoxybenzoic acid methyl ester IUPAC Name: methyl 5-[[[(2R)-1-(2-fluorophenyl)sulfonylpyrrolidine-2-carbonyl]amino]methyl]-2-methoxybenzoate Traditional Name: 5-[[[(2R)-1-(2-fluorophenyl)sulfonylprolyl]amino]methyl]-2-methoxy-benzoic acid methyl ester Formula: C21H23FN2O6S MolecularWeight: 450.480523

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2CCCN2S(=O)(=O)C3=CC=CC=C3F)C(=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)[C@H]2CCCN2S(=O)(=O)C3=CC=CC=C3F)C(=O)OC

InChI

InChI=1S/C21H23FN2O6S/c1-29-18-10-9-14(12-15(18)21(26)30-2)13-23-20(25)17-7-5-11-24(17)31(27,28)19-8-4-3-6-16(19)22/h3-4,6,8-10,12,17H,5,7,11,13H2,1-2H3,(H,23,25)/t17-/m1/s1