4-(4-chloranyl-3-methyl-phenoxy)-1-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]butan-1-one

Systemtic Name: 4-(4-chloranyl-3-methyl-phenoxy)-1-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]butan-1-one Openeye Name: 4-(4-chloro-3-methyl-phenoxy)-1-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]butan-1-one CAS Name: 4-(4-chloro-3-methylphenoxy)-1-[4-(2,4,6-trimethylphenyl)sulfonyl-1-piperazinyl]-1-butanone IUPAC Name: 4-(4-chloro-3-methylphenoxy)-1-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]butan-1-one Traditional Name: 4-(4-chloro-3-methyl-phenoxy)-1-(4-mesitylsulfonylpiperazino)butan-1-one Formula: C24H31ClN2O4S MolecularWeight: 479.03194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)CCCOC3=CC(=C(C=C3)Cl)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)CCCOC3=CC(=C(C=C3)Cl)C)C

InChI

InChI=1S/C24H31ClN2O4S/c1-17-14-19(3)24(20(4)15-17)32(29,30)27-11-9-26(10-12-27)23(28)6-5-13-31-21-7-8-22(25)18(2)16-21/h7-8,14-16H,5-6,9-13H2,1-4H3