2-(4-chloranyl-2-methyl-phenoxy)-1-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(4-chloranyl-2-methyl-phenoxy)-1-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-(4-chloro-2-methyl-phenoxy)-1-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethanone CAS Name: 2-(4-chloro-2-methylphenoxy)-1-[4-(2,5-dimethoxyphenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-(4-chloro-2-methylphenoxy)-1-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-(4-chloro-2-methyl-phenoxy)-1-[4-(2,5-dimethoxyphenyl)sulfonylpiperazino]ethanone Formula: C21H25ClN2O6S MolecularWeight: 468.951

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25ClN2O6S/c1-15-12-16(22)4-6-18(15)30-14-21(25)23-8-10-24(11-9-23)31(26,27)20-13-17(28-2)5-7-19(20)29-3/h4-7,12-13H,8-11,14H2,1-3H3