3-(4-methoxyphenoxy)-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]propan-1-one

Systemtic Name: 3-(4-methoxyphenoxy)-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 1-(4-benzylsulfonylpiperazin-1-yl)-3-(4-methoxyphenoxy)propan-1-one CAS Name: 3-(4-methoxyphenoxy)-1-[4-(phenylmethyl)sulfonyl-1-piperazinyl]-1-propanone IUPAC Name: 1-(4-benzylsulfonylpiperazin-1-yl)-3-(4-methoxyphenoxy)propan-1-one Traditional Name: 1-(4-benzylsulfonylpiperazino)-3-(4-methoxyphenoxy)propan-1-one Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCCC(=O)N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)OCCC(=O)N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H26N2O5S/c1-27-19-7-9-20(10-8-19)28-16-11-21(24)22-12-14-23(15-13-22)29(25,26)17-18-5-3-2-4-6-18/h2-10H,11-17H2,1H3