3-[4-[2,2-bis(chloranyl)ethanoyl]piperazin-1-yl]-4-methoxy-N-methyl-N-phenethyl-benzenesulfonamide

Systemtic Name: 3-[4-[2,2-bis(chloranyl)ethanoyl]piperazin-1-yl]-4-methoxy-N-methyl-N-phenethyl-benzenesulfonamide Openeye Name: 3-[4-(2,2-dichloroacetyl)piperazin-1-yl]-4-methoxy-N-methyl-N-phenethyl-benzenesulfonamide CAS Name: 3-[4-(2,2-dichloro-1-oxoethyl)-1-piperazinyl]-4-methoxy-N-methyl-N-phenethylbenzenesulfonamide IUPAC Name: 3-[4-(2,2-dichloroacetyl)piperazin-1-yl]-4-methoxy-N-methyl-N-phenethylbenzenesulfonamide Traditional Name: 3-[4-(2,2-dichloroacetyl)piperazino]-4-methoxy-N-methyl-N-phenethyl-benzenesulfonamide Formula: C22H27Cl2N3O4S MolecularWeight: 500.43848

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)OC)N3CCN(CC3)C(=O)C(Cl)Cl

Isomeric SMILES

CN(CCC1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)OC)N3CCN(CC3)C(=O)C(Cl)Cl

InChI

InChI=1S/C22H27Cl2N3O4S/c1-25(11-10-17-6-4-3-5-7-17)32(29,30)18-8-9-20(31-2)19(16-18)26-12-14-27(15-13-26)22(28)21(23)24/h3-9,16,21H,10-15H2,1-2H3