3-(4-methoxyphenyl)-1-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]propan-1-one

Systemtic Name: 3-(4-methoxyphenyl)-1-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 3-(4-methoxyphenyl)-1-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]propan-1-one CAS Name: 3-(4-methoxyphenyl)-1-[4-(2,4,6-trimethylphenyl)sulfonyl-1-piperazinyl]-1-propanone IUPAC Name: 3-(4-methoxyphenyl)-1-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]propan-1-one Traditional Name: 1-(4-mesitylsulfonylpiperazino)-3-(4-methoxyphenyl)propan-1-one Formula: C23H30N2O4S MolecularWeight: 430.5603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)CCC3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)CCC3=CC=C(C=C3)OC)C

InChI

InChI=1S/C23H30N2O4S/c1-17-15-18(2)23(19(3)16-17)30(27,28)25-13-11-24(12-14-25)22(26)10-7-20-5-8-21(29-4)9-6-20/h5-6,8-9,15-16H,7,10-14H2,1-4H3