(4-ethanoyl-2-methoxy-phenyl) 3-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: (4-ethanoyl-2-methoxy-phenyl) 3-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: (4-acetyl-2-methoxy-phenyl) 3-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 3-(1-pyrrolidinylsulfonyl)benzoic acid (4-acetyl-2-methoxyphenyl) ester IUPAC Name: (4-acetyl-2-methoxyphenyl) 3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 3-pyrrolidinosulfonylbenzoic acid (4-acetyl-2-methoxy-phenyl) ester Formula: C20H21NO6S MolecularWeight: 403.44884

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21NO6S/c1-14(22)15-8-9-18(19(13-15)26-2)27-20(23)16-6-5-7-17(12-16)28(24,25)21-10-3-4-11-21/h5-9,12-13H,3-4,10-11H2,1-2H3