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

Systemtic Name: (4-acetamidophenyl) 3-piperidin-1-ylsulfonylbenzoate Openeye Name: (4-acetamidophenyl) 3-(1-piperidylsulfonyl)benzoate CAS Name: 3-(1-piperidinylsulfonyl)benzoic acid (4-acetamidophenyl) ester IUPAC Name: (4-acetamidophenyl) 3-piperidin-1-ylsulfonylbenzoate Traditional Name: 3-piperidinosulfonylbenzoic acid (4-acetamidophenyl) ester Formula: C20H22N2O5S MolecularWeight: 402.46408

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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)N3CCCCC3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)OC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H22N2O5S/c1-15(23)21-17-8-10-18(11-9-17)27-20(24)16-6-5-7-19(14-16)28(25,26)22-12-3-2-4-13-22/h5-11,14H,2-4,12-13H2,1H3,(H,21,23)