1-[4-[2-oxidanylidene-2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethoxy]phenyl]propan-1-one

Systemtic Name: 1-[4-[2-oxidanylidene-2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethoxy]phenyl]propan-1-one Openeye Name: 1-[4-[2-(4-benzylsulfonylpiperazin-1-yl)-2-oxo-ethoxy]phenyl]propan-1-one CAS Name: 1-[4-[2-oxo-2-[4-(phenylmethyl)sulfonyl-1-piperazinyl]ethoxy]phenyl]-1-propanone IUPAC Name: 1-[4-[2-(4-benzylsulfonylpiperazin-1-yl)-2-oxoethoxy]phenyl]propan-1-one Traditional Name: 1-[4-[2-(4-benzylsulfonylpiperazino)-2-keto-ethoxy]phenyl]propan-1-one Formula: C22H26N2O5S MolecularWeight: 430.51724

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OCC(=O)N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OCC(=O)N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C22H26N2O5S/c1-2-21(25)19-8-10-20(11-9-19)29-16-22(26)23-12-14-24(15-13-23)30(27,28)17-18-6-4-3-5-7-18/h3-11H,2,12-17H2,1H3