2-[2-[4-(2-chlorophenyl)-2-thiophen-2-ylcarbonyl-phenoxy]ethyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[2-[4-(2-chlorophenyl)-2-thiophen-2-ylcarbonyl-phenoxy]ethyl-methyl-amino]ethanoic acid Openeye Name: 2-[2-[4-(2-chlorophenyl)-2-(thiophene-2-carbonyl)phenoxy]ethyl-methyl-amino]acetic acid CAS Name: 2-[2-[4-(2-chlorophenyl)-2-[oxo(thiophen-2-yl)methyl]phenoxy]ethyl-methylamino]acetic acid IUPAC Name: 2-[2-[4-(2-chlorophenyl)-2-(thiophene-2-carbonyl)phenoxy]ethyl-methylamino]acetic acid Traditional Name: 2-[2-[4-(2-chlorophenyl)-2-(2-thenoyl)phenoxy]ethyl-methyl-amino]acetic acid Formula: C22H20ClNO4S MolecularWeight: 429.9165

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC1=C(C=C(C=C1)C2=CC=CC=C2Cl)C(=O)C3=CC=CS3)CC(=O)O

Isomeric SMILES

CN(CCOC1=C(C=C(C=C1)C2=CC=CC=C2Cl)C(=O)C3=CC=CS3)CC(=O)O

InChI

InChI=1S/C22H20ClNO4S/c1-24(14-21(25)26)10-11-28-19-9-8-15(16-5-2-3-6-18(16)23)13-17(19)22(27)20-7-4-12-29-20/h2-9,12-13H,10-11,14H2,1H3,(H,25,26)