1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-(2,3,5-trimethylphenoxy)propan-1-one

Systemtic Name: 1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-(2,3,5-trimethylphenoxy)propan-1-one Openeye Name: 1-[4-(p-tolylsulfonyl)piperazin-1-yl]-2-(2,3,5-trimethylphenoxy)propan-1-one CAS Name: 1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-2-(2,3,5-trimethylphenoxy)-1-propanone IUPAC Name: 1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-(2,3,5-trimethylphenoxy)propan-1-one Traditional Name: 1-(4-tosylpiperazino)-2-(2,3,5-trimethylphenoxy)propan-1-one Formula: C23H30N2O4S MolecularWeight: 430.5603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C(C)OC3=CC(=CC(=C3C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C(C)OC3=CC(=CC(=C3C)C)C

InChI

InChI=1S/C23H30N2O4S/c1-16-6-8-21(9-7-16)30(27,28)25-12-10-24(11-13-25)23(26)20(5)29-22-15-17(2)14-18(3)19(22)4/h6-9,14-15,20H,10-13H2,1-5H3