(2,6-dimethylphenyl) 2-(5-piperidin-1-ylsulfonylthiophen-2-yl)ethanoate

Systemtic Name: (2,6-dimethylphenyl) 2-(5-piperidin-1-ylsulfonylthiophen-2-yl)ethanoate Openeye Name: (2,6-dimethylphenyl) 2-[5-(1-piperidylsulfonyl)-2-thienyl]acetate CAS Name: 2-[5-(1-piperidinylsulfonyl)-2-thiophenyl]acetic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) 2-(5-piperidin-1-ylsulfonylthiophen-2-yl)acetate Traditional Name: 2-(5-piperidinosulfonyl-2-thienyl)acetic acid (2,6-dimethylphenyl) ester Formula: C19H23NO4S2 MolecularWeight: 393.52022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OC(=O)CC2=CC=C(S2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C(=CC=C1)C)OC(=O)CC2=CC=C(S2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C19H23NO4S2/c1-14-7-6-8-15(2)19(14)24-17(21)13-16-9-10-18(25-16)26(22,23)20-11-4-3-5-12-20/h6-10H,3-5,11-13H2,1-2H3