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

Systemtic Name: 3-(2,3-dimethoxyphenyl)-1-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 3-(2,3-dimethoxyphenyl)-1-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]propan-1-one CAS Name: 3-(2,3-dimethoxyphenyl)-1-[4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]-1-propanone IUPAC Name: 3-(2,3-dimethoxyphenyl)-1-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]propan-1-one Traditional Name: 3-(2,3-dimethoxyphenyl)-1-(4-p-phenetylsulfonylpiperazino)propan-1-one Formula: C23H30N2O6S MolecularWeight: 462.5591

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCC3=C(C(=CC=C3)OC)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCC3=C(C(=CC=C3)OC)OC

InChI

InChI=1S/C23H30N2O6S/c1-4-31-19-9-11-20(12-10-19)32(27,28)25-16-14-24(15-17-25)22(26)13-8-18-6-5-7-21(29-2)23(18)30-3/h5-7,9-12H,4,8,13-17H2,1-3H3