1-(2,4-dimethylphenoxy)-3-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]propan-2-ol

Systemtic Name: 1-(2,4-dimethylphenoxy)-3-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]propan-2-ol Openeye Name: 1-(2,4-dimethylphenoxy)-3-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]propan-2-ol CAS Name: 1-(2,4-dimethylphenoxy)-3-[4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]-2-propanol IUPAC Name: 1-(2,4-dimethylphenoxy)-3-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]propan-2-ol Traditional Name: 1-(2,4-dimethylphenoxy)-3-(4-p-phenetylsulfonylpiperazino)propan-2-ol Formula: C23H32N2O5S MolecularWeight: 448.57558

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(COC3=C(C=C(C=C3)C)C)O

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(COC3=C(C=C(C=C3)C)C)O

InChI

InChI=1S/C23H32N2O5S/c1-4-29-21-6-8-22(9-7-21)31(27,28)25-13-11-24(12-14-25)16-20(26)17-30-23-10-5-18(2)15-19(23)3/h5-10,15,20,26H,4,11-14,16-17H2,1-3H3