(4-acetamidophenyl) 3-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: (4-acetamidophenyl) 3-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: (4-acetamidophenyl) 3-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 3-(1-pyrrolidinylsulfonyl)benzoic acid (4-acetamidophenyl) ester IUPAC Name: (4-acetamidophenyl) 3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 3-pyrrolidinosulfonylbenzoic acid (4-acetamidophenyl) ester Formula: C19H20N2O5S MolecularWeight: 388.4375

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)OC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)OC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C19H20N2O5S/c1-14(22)20-16-7-9-17(10-8-16)26-19(23)15-5-4-6-18(13-15)27(24,25)21-11-2-3-12-21/h4-10,13H,2-3,11-12H2,1H3,(H,20,22)