(1-oxidanylidene-1-phenyl-propan-2-yl) 4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzoate

Systemtic Name: (1-oxidanylidene-1-phenyl-propan-2-yl) 4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzoate Openeye Name: (1-methyl-2-oxo-2-phenyl-ethyl) 4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzoate CAS Name: 4-methoxy-3-(1-pyrrolidinylsulfonyl)benzoic acid (1-oxo-1-phenylpropan-2-yl) ester IUPAC Name: (1-oxo-1-phenylpropan-2-yl) 4-methoxy-3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-methoxy-3-pyrrolidinosulfonyl-benzoic acid (2-keto-1-methyl-2-phenyl-ethyl) ester Formula: C21H23NO6S MolecularWeight: 417.47542

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=CC=C1)OC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC(C(=O)C1=CC=CC=C1)OC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C21H23NO6S/c1-15(20(23)16-8-4-3-5-9-16)28-21(24)17-10-11-18(27-2)19(14-17)29(25,26)22-12-6-7-13-22/h3-5,8-11,14-15H,6-7,12-13H2,1-2H3