1-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-3-(2,5-dimethoxyphenyl)propan-1-one

Systemtic Name: 1-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-3-(2,5-dimethoxyphenyl)propan-1-one Openeye Name: 1-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-3-(2,5-dimethoxyphenyl)propan-1-one CAS Name: 1-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-3-(2,5-dimethoxyphenyl)-1-propanone IUPAC Name: 1-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-3-(2,5-dimethoxyphenyl)propan-1-one Traditional Name: 1-[4-(4-chlorophenyl)sulfonylpiperazino]-3-(2,5-dimethoxyphenyl)propan-1-one Formula: C21H25ClN2O5S MolecularWeight: 452.9516

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H25ClN2O5S/c1-28-18-6-9-20(29-2)16(15-18)3-10-21(25)23-11-13-24(14-12-23)30(26,27)19-7-4-17(22)5-8-19/h4-9,15H,3,10-14H2,1-2H3