2-[2-[4-(3-chlorophenyl)-2-thiophen-2-ylcarbonyl-phenoxy]ethyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[2-[4-(3-chlorophenyl)-2-thiophen-2-ylcarbonyl-phenoxy]ethyl-methyl-amino]ethanoic acid Openeye Name: 2-[2-[4-(3-chlorophenyl)-2-(thiophene-2-carbonyl)phenoxy]ethyl-methyl-amino]acetic acid CAS Name: 2-[2-[4-(3-chlorophenyl)-2-[oxo(thiophen-2-yl)methyl]phenoxy]ethyl-methylamino]acetic acid IUPAC Name: 2-[2-[4-(3-chlorophenyl)-2-(thiophene-2-carbonyl)phenoxy]ethyl-methylamino]acetic acid Traditional Name: 2-[2-[4-(3-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=C2)Cl)C(=O)C3=CC=CS3)CC(=O)O

Isomeric SMILES

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

InChI

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