2-[4-bromanyl-1-(4-methylphenyl)sulfonyl-pyrrolidin-3-yl]oxyethanol

Systemtic Name: 2-[4-bromanyl-1-(4-methylphenyl)sulfonyl-pyrrolidin-3-yl]oxyethanol Openeye Name: 2-[4-bromo-1-(p-tolylsulfonyl)pyrrolidin-3-yl]oxyethanol CAS Name: 2-[[4-bromo-1-(4-methylphenyl)sulfonyl-3-pyrrolidinyl]oxy]ethanol IUPAC Name: 2-[4-bromo-1-(4-methylphenyl)sulfonylpyrrolidin-3-yl]oxyethanol Traditional Name: 2-(4-bromo-1-tosyl-pyrrolidin-3-yl)oxyethanol Formula: C13H18BrNO4S MolecularWeight: 364.25532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC(C(C2)Br)OCCO

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC(C(C2)Br)OCCO

InChI

InChI=1S/C13H18BrNO4S/c1-10-2-4-11(5-3-10)20(17,18)15-8-12(14)13(9-15)19-7-6-16/h2-5,12-13,16H,6-9H2,1H3