2-[1-[2-(3-chlorophenyl)sulfanylphenoxy]butan-2-yl-ethyl-amino]ethanoic acid

Systemtic Name: 2-[1-[2-(3-chlorophenyl)sulfanylphenoxy]butan-2-yl-ethyl-amino]ethanoic acid Openeye Name: 2-[1-[[2-(3-chlorophenyl)sulfanylphenoxy]methyl]propyl-ethyl-amino]acetic acid CAS Name: 2-[1-[2-[(3-chlorophenyl)thio]phenoxy]butan-2-yl-ethylamino]acetic acid IUPAC Name: 2-[1-[2-(3-chlorophenyl)sulfanylphenoxy]butan-2-yl-ethylamino]acetic acid Traditional Name: 2-[1-[[2-[(3-chlorophenyl)thio]phenoxy]methyl]propyl-ethyl-amino]acetic acid Formula: C20H24ClNO3S MolecularWeight: 393.92746

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COC1=CC=CC=C1SC2=CC(=CC=C2)Cl)N(CC)CC(=O)O

Isomeric SMILES

CCC(COC1=CC=CC=C1SC2=CC(=CC=C2)Cl)N(CC)CC(=O)O

InChI

InChI=1S/C20H24ClNO3S/c1-3-16(22(4-2)13-20(23)24)14-25-18-10-5-6-11-19(18)26-17-9-7-8-15(21)12-17/h5-12,16H,3-4,13-14H2,1-2H3,(H,23,24)