1,3-benzodioxol-5-yl 2-(4-piperidin-1-ylsulfonylphenyl)ethanoate

Systemtic Name: 1,3-benzodioxol-5-yl 2-(4-piperidin-1-ylsulfonylphenyl)ethanoate Openeye Name: 1,3-benzodioxol-5-yl 2-[4-(1-piperidylsulfonyl)phenyl]acetate CAS Name: 2-[4-(1-piperidinylsulfonyl)phenyl]acetic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl 2-(4-piperidin-1-ylsulfonylphenyl)acetate Traditional Name: 2-(4-piperidinosulfonylphenyl)acetic acid 1,3-benzodioxol-5-yl ester Formula: C20H21NO6S MolecularWeight: 403.44884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CC(=O)OC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CC(=O)OC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H21NO6S/c22-20(27-16-6-9-18-19(13-16)26-14-25-18)12-15-4-7-17(8-5-15)28(23,24)21-10-2-1-3-11-21/h4-9,13H,1-3,10-12,14H2