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

Systemtic Name: 1-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]-3-(4-methoxyphenyl)propan-1-one Openeye Name: 1-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]-3-(4-methoxyphenyl)propan-1-one CAS Name: 1-[4-(2,5-dimethoxyphenyl)sulfonyl-1-piperazinyl]-3-(4-methoxyphenyl)-1-propanone IUPAC Name: 1-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]-3-(4-methoxyphenyl)propan-1-one Traditional Name: 1-[4-(2,5-dimethoxyphenyl)sulfonylpiperazino]-3-(4-methoxyphenyl)propan-1-one Formula: C22H28N2O6S MolecularWeight: 448.53252

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O6S/c1-28-18-7-4-17(5-8-18)6-11-22(25)23-12-14-24(15-13-23)31(26,27)21-16-19(29-2)9-10-20(21)30-3/h4-5,7-10,16H,6,11-15H2,1-3H3