methyl 4-[[(1-methylsulfonylpyrrolidin-2-yl)carbonylamino]methyl]benzoate

Systemtic Name: methyl 4-[[(1-methylsulfonylpyrrolidin-2-yl)carbonylamino]methyl]benzoate Openeye Name: methyl 4-[[(1-methylsulfonylpyrrolidine-2-carbonyl)amino]methyl]benzoate CAS Name: 4-[[[(1-methylsulfonyl-2-pyrrolidinyl)-oxomethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(1-methylsulfonylpyrrolidine-2-carbonyl)amino]methyl]benzoate Traditional Name: 4-[[(1-mesylprolyl)amino]methyl]benzoic acid methyl ester Formula: C15H20N2O5S MolecularWeight: 340.3947

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)C2CCCN2S(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)C2CCCN2S(=O)(=O)C

InChI

InChI=1S/C15H20N2O5S/c1-22-15(19)12-7-5-11(6-8-12)10-16-14(18)13-4-3-9-17(13)23(2,20)21/h5-8,13H,3-4,9-10H2,1-2H3,(H,16,18)