phenacyl 3-(4-piperidin-1-ylsulfonylphenyl)propanoate

Systemtic Name: phenacyl 3-(4-piperidin-1-ylsulfonylphenyl)propanoate Openeye Name: phenacyl 3-[4-(1-piperidylsulfonyl)phenyl]propanoate CAS Name: 3-[4-(1-piperidinylsulfonyl)phenyl]propanoic acid phenacyl ester IUPAC Name: phenacyl 3-(4-piperidin-1-ylsulfonylphenyl)propanoate Traditional Name: 3-(4-piperidinosulfonylphenyl)propionic acid phenacyl ester Formula: C22H25NO5S MolecularWeight: 415.5026

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)OCC(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)OCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H25NO5S/c24-21(19-7-3-1-4-8-19)17-28-22(25)14-11-18-9-12-20(13-10-18)29(26,27)23-15-5-2-6-16-23/h1,3-4,7-10,12-13H,2,5-6,11,14-17H2