2-[5-aminocarbonyl-9-[[4-(trifluoromethyl)thiophen-2-yl]methyl]carbazol-4-yl]oxypropanoic acid

Systemtic Name: 2-[5-aminocarbonyl-9-[[4-(trifluoromethyl)thiophen-2-yl]methyl]carbazol-4-yl]oxypropanoic acid Openeye Name: 2-[5-carbamoyl-9-[[4-(trifluoromethyl)-2-thienyl]methyl]carbazol-4-yl]oxypropanoic acid CAS Name: 2-[[5-carbamoyl-9-[[4-(trifluoromethyl)-2-thiophenyl]methyl]-4-carbazolyl]oxy]propanoic acid IUPAC Name: 2-[5-carbamoyl-9-[[4-(trifluoromethyl)thiophen-2-yl]methyl]carbazol-4-yl]oxypropanoic acid Traditional Name: 2-[5-carbamoyl-9-[[4-(trifluoromethyl)-2-thienyl]methyl]carbazol-4-yl]oxypropionic acid Formula: C22H17F3N2O4S MolecularWeight: 462.44159

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)OC1=CC=CC2=C1C3=C(C=CC=C3N2CC4=CC(=CS4)C(F)(F)F)C(=O)N

Isomeric SMILES

CC(C(=O)O)OC1=CC=CC2=C1C3=C(C=CC=C3N2CC4=CC(=CS4)C(F)(F)F)C(=O)N

InChI

InChI=1S/C22H17F3N2O4S/c1-11(21(29)30)31-17-7-3-6-16-19(17)18-14(20(26)28)4-2-5-15(18)27(16)9-13-8-12(10-32-13)22(23,24)25/h2-8,10-11H,9H2,1H3,(H2,26,28)(H,29,30)