(phenylmethyl) 2-(4-piperidin-1-ylsulfonylphenyl)ethanoate

Systemtic Name: (phenylmethyl) 2-(4-piperidin-1-ylsulfonylphenyl)ethanoate Openeye Name: benzyl 2-[4-(1-piperidylsulfonyl)phenyl]acetate CAS Name: 2-[4-(1-piperidinylsulfonyl)phenyl]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(4-piperidin-1-ylsulfonylphenyl)acetate Traditional Name: 2-(4-piperidinosulfonylphenyl)acetic acid benzyl ester Formula: C20H23NO4S MolecularWeight: 373.46592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C20H23NO4S/c22-20(25-16-18-7-3-1-4-8-18)15-17-9-11-19(12-10-17)26(23,24)21-13-5-2-6-14-21/h1,3-4,7-12H,2,5-6,13-16H2