(2S)-1-[4-(phenylsulfonyl)piperazin-1-yl]-3-(2-prop-2-enylphenoxy)propan-2-ol

Systemtic Name: (2S)-1-[4-(phenylsulfonyl)piperazin-1-yl]-3-(2-prop-2-enylphenoxy)propan-2-ol Openeye Name: (2S)-1-(2-allylphenoxy)-3-[4-(benzenesulfonyl)piperazin-1-yl]propan-2-ol CAS Name: (2S)-1-[4-(benzenesulfonyl)-1-piperazinyl]-3-(2-prop-2-enylphenoxy)-2-propanol IUPAC Name: (2S)-1-[4-(benzenesulfonyl)piperazin-1-yl]-3-(2-prop-2-enylphenoxy)propan-2-ol Traditional Name: (2S)-1-(2-allylphenoxy)-3-(4-besylpiperazino)propan-2-ol Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CC=CC=C1OCC(CN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)O

Isomeric SMILES

C=CCC1=CC=CC=C1OC[C@H](CN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C22H28N2O4S/c1-2-8-19-9-6-7-12-22(19)28-18-20(25)17-23-13-15-24(16-14-23)29(26,27)21-10-4-3-5-11-21/h2-7,9-12,20,25H,1,8,13-18H2/t20-/m0/s1