1-[2-(3-bromanylphenoxy)ethylamino]-3-(3-methyl-4-methylsulfonyl-phenoxy)propan-2-ol

Systemtic Name: 1-[2-(3-bromanylphenoxy)ethylamino]-3-(3-methyl-4-methylsulfonyl-phenoxy)propan-2-ol Openeye Name: 1-[2-(3-bromophenoxy)ethylamino]-3-(3-methyl-4-methylsulfonyl-phenoxy)propan-2-ol CAS Name: 1-[2-(3-bromophenoxy)ethylamino]-3-(3-methyl-4-methylsulfonylphenoxy)-2-propanol IUPAC Name: 1-[2-(3-bromophenoxy)ethylamino]-3-(3-methyl-4-methylsulfonylphenoxy)propan-2-ol Traditional Name: 1-[2-(3-bromophenoxy)ethylamino]-3-(4-mesyl-3-methyl-phenoxy)propan-2-ol Formula: C19H24BrNO5S MolecularWeight: 458.36656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(CNCCOC2=CC(=CC=C2)Br)O)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(CNCCOC2=CC(=CC=C2)Br)O)S(=O)(=O)C

InChI

InChI=1S/C19H24BrNO5S/c1-14-10-18(6-7-19(14)27(2,23)24)26-13-16(22)12-21-8-9-25-17-5-3-4-15(20)11-17/h3-7,10-11,16,21-22H,8-9,12-13H2,1-2H3