1-(4-ethylphenoxy)-3-[4-(phenylsulfonyl)piperazin-1-yl]propan-2-ol

Systemtic Name: 1-(4-ethylphenoxy)-3-[4-(phenylsulfonyl)piperazin-1-yl]propan-2-ol Openeye Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-3-(4-ethylphenoxy)propan-2-ol CAS Name: 1-[4-(benzenesulfonyl)-1-piperazinyl]-3-(4-ethylphenoxy)-2-propanol IUPAC Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-3-(4-ethylphenoxy)propan-2-ol Traditional Name: 1-(4-besylpiperazino)-3-(4-ethylphenoxy)propan-2-ol Formula: C21H28N2O4S MolecularWeight: 404.52302

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC(CN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)O

Isomeric SMILES

CCC1=CC=C(C=C1)OCC(CN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C21H28N2O4S/c1-2-18-8-10-20(11-9-18)27-17-19(24)16-22-12-14-23(15-13-22)28(25,26)21-6-4-3-5-7-21/h3-11,19,24H,2,12-17H2,1H3