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

Systemtic Name: 2-[2-[4-(3,4-dimethylphenyl)-2-thiophen-2-ylcarbonyl-phenoxy]ethyl-methyl-amino]ethanoic acid Openeye Name: 2-[2-[4-(3,4-dimethylphenyl)-2-(thiophene-2-carbonyl)phenoxy]ethyl-methyl-amino]acetic acid CAS Name: 2-[2-[4-(3,4-dimethylphenyl)-2-[oxo(thiophen-2-yl)methyl]phenoxy]ethyl-methylamino]acetic acid IUPAC Name: 2-[2-[4-(3,4-dimethylphenyl)-2-(thiophene-2-carbonyl)phenoxy]ethyl-methylamino]acetic acid Traditional Name: 2-[2-[4-(3,4-dimethylphenyl)-2-(2-thenoyl)phenoxy]ethyl-methyl-amino]acetic acid Formula: C24H25NO4S MolecularWeight: 423.5246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC(=C(C=C2)OCCN(C)CC(=O)O)C(=O)C3=CC=CS3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC(=C(C=C2)OCCN(C)CC(=O)O)C(=O)C3=CC=CS3)C

InChI

InChI=1S/C24H25NO4S/c1-16-6-7-18(13-17(16)2)19-8-9-21(29-11-10-25(3)15-23(26)27)20(14-19)24(28)22-5-4-12-30-22/h4-9,12-14H,10-11,15H2,1-3H3,(H,26,27)