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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)COC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC1=CC=CC(=C1)COC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H27NO5S/c1-27-20-7-5-6-19(16-20)17-28-22(24)13-10-18-8-11-21(12-9-18)29(25,26)23-14-3-2-4-15-23/h5-9,11-12,16H,2-4,10,13-15,17H2,1H3