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

Systemtic Name: 1-(3-methylphenoxy)-3-[4-(phenylsulfonyl)piperazin-1-yl]propan-2-ol Openeye Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-3-(3-methylphenoxy)propan-2-ol CAS Name: 1-[4-(benzenesulfonyl)-1-piperazinyl]-3-(3-methylphenoxy)-2-propanol IUPAC Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-3-(3-methylphenoxy)propan-2-ol Traditional Name: 1-(4-besylpiperazino)-3-(3-methylphenoxy)propan-2-ol Formula: C20H26N2O4S MolecularWeight: 390.49644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(CN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)O

Isomeric SMILES

CC1=CC(=CC=C1)OCC(CN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C20H26N2O4S/c1-17-6-5-7-19(14-17)26-16-18(23)15-21-10-12-22(13-11-21)27(24,25)20-8-3-2-4-9-20/h2-9,14,18,23H,10-13,15-16H2,1H3