(2-oxidanylidene-1-phenyl-2-pyrrolidin-1-yl-ethyl) 4-(methylsulfonylmethyl)benzoate

Systemtic Name: (2-oxidanylidene-1-phenyl-2-pyrrolidin-1-yl-ethyl) 4-(methylsulfonylmethyl)benzoate Openeye Name: (2-oxo-1-phenyl-2-pyrrolidin-1-yl-ethyl) 4-(methylsulfonylmethyl)benzoate CAS Name: 4-(methylsulfonylmethyl)benzoic acid [2-oxo-1-phenyl-2-(1-pyrrolidinyl)ethyl] ester IUPAC Name: (2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl) 4-(methylsulfonylmethyl)benzoate Traditional Name: 4-(mesylmethyl)benzoic acid (2-keto-1-phenyl-2-pyrrolidino-ethyl) ester Formula: C21H23NO5S MolecularWeight: 401.47602

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CC1=CC=C(C=C1)C(=O)OC(C2=CC=CC=C2)C(=O)N3CCCC3

Isomeric SMILES

CS(=O)(=O)CC1=CC=C(C=C1)C(=O)OC(C2=CC=CC=C2)C(=O)N3CCCC3

InChI

InChI=1S/C21H23NO5S/c1-28(25,26)15-16-9-11-18(12-10-16)21(24)27-19(17-7-3-2-4-8-17)20(23)22-13-5-6-14-22/h2-4,7-12,19H,5-6,13-15H2,1H3