methyl 2-[4-[4-(phenylmethyl)piperidin-1-yl]sulfonylphenoxy]ethanoate

Systemtic Name: methyl 2-[4-[4-(phenylmethyl)piperidin-1-yl]sulfonylphenoxy]ethanoate Openeye Name: methyl 2-[4-[(4-benzyl-1-piperidyl)sulfonyl]phenoxy]acetate CAS Name: 2-[4-[[4-(phenylmethyl)-1-piperidinyl]sulfonyl]phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[4-(4-benzylpiperidin-1-yl)sulfonylphenoxy]acetate Traditional Name: 2-[4-(4-benzylpiperidino)sulfonylphenoxy]acetic acid methyl ester Formula: C21H25NO5S MolecularWeight: 403.4919

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C21H25NO5S/c1-26-21(23)16-27-19-7-9-20(10-8-19)28(24,25)22-13-11-18(12-14-22)15-17-5-3-2-4-6-17/h2-10,18H,11-16H2,1H3