(2-methoxy-2-oxidanylidene-1-phenyl-ethyl) 4-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: (2-methoxy-2-oxidanylidene-1-phenyl-ethyl) 4-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: (2-methoxy-2-oxo-1-phenyl-ethyl) 4-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 4-(1-pyrrolidinylsulfonyl)benzoic acid (2-methoxy-2-oxo-1-phenylethyl) ester IUPAC Name: (2-methoxy-2-oxo-1-phenylethyl) 4-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-pyrrolidinosulfonylbenzoic acid (2-keto-2-methoxy-1-phenyl-ethyl) ester Formula: C20H21NO6S MolecularWeight: 403.44884

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21NO6S/c1-26-20(23)18(15-7-3-2-4-8-15)27-19(22)16-9-11-17(12-10-16)28(24,25)21-13-5-6-14-21/h2-4,7-12,18H,5-6,13-14H2,1H3