2-[3-[[3-(3-chlorophenyl)propyl-methylsulfonyl-amino]methyl]phenyl]ethanoic acid

Systemtic Name: 2-[3-[[3-(3-chlorophenyl)propyl-methylsulfonyl-amino]methyl]phenyl]ethanoic acid Openeye Name: 2-[3-[[3-(3-chlorophenyl)propyl-methylsulfonyl-amino]methyl]phenyl]acetic acid CAS Name: 2-[3-[[3-(3-chlorophenyl)propyl-methylsulfonylamino]methyl]phenyl]acetic acid IUPAC Name: 2-[3-[[3-(3-chlorophenyl)propyl-methylsulfonylamino]methyl]phenyl]acetic acid Traditional Name: 2-[3-[[3-(3-chlorophenyl)propyl-mesyl-amino]methyl]phenyl]acetic acid Formula: C19H22ClNO4S MolecularWeight: 395.90028

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CCCC1=CC(=CC=C1)Cl)CC2=CC=CC(=C2)CC(=O)O

Isomeric SMILES

CS(=O)(=O)N(CCCC1=CC(=CC=C1)Cl)CC2=CC=CC(=C2)CC(=O)O

InChI

InChI=1S/C19H22ClNO4S/c1-26(24,25)21(10-4-8-15-5-3-9-18(20)12-15)14-17-7-2-6-16(11-17)13-19(22)23/h2-3,5-7,9,11-12H,4,8,10,13-14H2,1H3,(H,22,23)