1-(3-methylphenoxy)-3-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]propan-2-ol

Systemtic Name: 1-(3-methylphenoxy)-3-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]propan-2-ol Openeye Name: 1-(3-methylphenoxy)-3-[4-[(E)-styryl]sulfonylpiperazin-1-yl]propan-2-ol CAS Name: 1-(3-methylphenoxy)-3-[4-[(E)-2-phenylethenyl]sulfonyl-1-piperazinyl]-2-propanol IUPAC Name: 1-(3-methylphenoxy)-3-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]propan-2-ol Traditional Name: 1-(3-methylphenoxy)-3-[4-[(E)-styryl]sulfonylpiperazino]propan-2-ol Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(CN2CCN(CC2)S(=O)(=O)C=CC3=CC=CC=C3)O

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O4S/c1-19-6-5-9-22(16-19)28-18-21(25)17-23-11-13-24(14-12-23)29(26,27)15-10-20-7-3-2-4-8-20/h2-10,15-16,21,25H,11-14,17-18H2,1H3/b15-10+