(2-methoxyphenyl)methyl 3-(4-piperidin-1-ylsulfonylphenyl)propanoate

Systemtic Name: (2-methoxyphenyl)methyl 3-(4-piperidin-1-ylsulfonylphenyl)propanoate Openeye Name: (2-methoxyphenyl)methyl 3-[4-(1-piperidylsulfonyl)phenyl]propanoate CAS Name: 3-[4-(1-piperidinylsulfonyl)phenyl]propanoic acid (2-methoxyphenyl)methyl ester IUPAC Name: (2-methoxyphenyl)methyl 3-(4-piperidin-1-ylsulfonylphenyl)propanoate Traditional Name: 3-(4-piperidinosulfonylphenyl)propionic acid o-anisyl ester Formula: C22H27NO5S MolecularWeight: 417.51848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1COC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC1=CC=CC=C1COC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H27NO5S/c1-27-21-8-4-3-7-19(21)17-28-22(24)14-11-18-9-12-20(13-10-18)29(25,26)23-15-5-2-6-16-23/h3-4,7-10,12-13H,2,5-6,11,14-17H2,1H3