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

Systemtic Name: 1-(4-chloranylphenoxy)-3-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]propan-2-ol Openeye Name: 1-(4-chlorophenoxy)-3-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]propan-2-ol CAS Name: 1-(4-chlorophenoxy)-3-[4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]-2-propanol IUPAC Name: 1-(4-chlorophenoxy)-3-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]propan-2-ol Traditional Name: 1-(4-chlorophenoxy)-3-(4-p-phenetylsulfonylpiperazino)propan-2-ol Formula: C21H27ClN2O5S MolecularWeight: 454.96748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27ClN2O5S/c1-2-28-19-7-9-21(10-8-19)30(26,27)24-13-11-23(12-14-24)15-18(25)16-29-20-5-3-17(22)4-6-20/h3-10,18,25H,2,11-16H2,1H3