2-(4-hydroxyphenyl)-1-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(4-hydroxyphenyl)-1-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-(4-hydroxyphenyl)-1-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]ethanone CAS Name: 2-(4-hydroxyphenyl)-1-[4-(2,4,6-trimethylphenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-(4-hydroxyphenyl)-1-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-(4-hydroxyphenyl)-1-(4-mesitylsulfonylpiperazino)ethanone Formula: C21H26N2O4S MolecularWeight: 402.50714

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)CC3=CC=C(C=C3)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)CC3=CC=C(C=C3)O)C

InChI

InChI=1S/C21H26N2O4S/c1-15-12-16(2)21(17(3)13-15)28(26,27)23-10-8-22(9-11-23)20(25)14-18-4-6-19(24)7-5-18/h4-7,12-13,24H,8-11,14H2,1-3H3