2-(3,5-dimethylphenoxy)-1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)ethanone

Systemtic Name: 2-(3,5-dimethylphenoxy)-1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)ethanone Openeye Name: 2-(3,5-dimethylphenoxy)-1-[4-(2-naphthylsulfonyl)piperazin-1-yl]ethanone CAS Name: 2-(3,5-dimethylphenoxy)-1-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]ethanone IUPAC Name: 2-(3,5-dimethylphenoxy)-1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)ethanone Traditional Name: 2-(3,5-dimethylphenoxy)-1-[4-(2-naphthylsulfonyl)piperazino]ethanone Formula: C24H26N2O4S MolecularWeight: 438.53924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)C

InChI

InChI=1S/C24H26N2O4S/c1-18-13-19(2)15-22(14-18)30-17-24(27)25-9-11-26(12-10-25)31(28,29)23-8-7-20-5-3-4-6-21(20)16-23/h3-8,13-16H,9-12,17H2,1-2H3