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

Systemtic Name: (4-ethylphenyl) 3-(4-piperidin-1-ylsulfonylphenyl)propanoate Openeye Name: (4-ethylphenyl) 3-[4-(1-piperidylsulfonyl)phenyl]propanoate CAS Name: 3-[4-(1-piperidinylsulfonyl)phenyl]propanoic acid (4-ethylphenyl) ester IUPAC Name: (4-ethylphenyl) 3-(4-piperidin-1-ylsulfonylphenyl)propanoate Traditional Name: 3-(4-piperidinosulfonylphenyl)propionic acid (4-ethylphenyl) ester Formula: C22H27NO4S MolecularWeight: 401.51908

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCC1=CC=C(C=C1)OC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H27NO4S/c1-2-18-6-11-20(12-7-18)27-22(24)15-10-19-8-13-21(14-9-19)28(25,26)23-16-4-3-5-17-23/h6-9,11-14H,2-5,10,15-17H2,1H3