3-azanyl-2-[6-methyl-7-[4-oxidanyl-3-(trifluoromethyl)phenoxy]-2,3-dihydro-1H-inden-4-yl]-3-oxidanylidene-propanoic acid

Systemtic Name: 3-azanyl-2-[6-methyl-7-[4-oxidanyl-3-(trifluoromethyl)phenoxy]-2,3-dihydro-1H-inden-4-yl]-3-oxidanylidene-propanoic acid Openeye Name: 3-amino-2-[7-[4-hydroxy-3-(trifluoromethyl)phenoxy]-6-methyl-indan-4-yl]-3-oxo-propanoic acid CAS Name: 3-amino-2-[7-[4-hydroxy-3-(trifluoromethyl)phenoxy]-6-methyl-2,3-dihydro-1H-inden-4-yl]-3-oxopropanoic acid IUPAC Name: 3-amino-2-[7-[4-hydroxy-3-(trifluoromethyl)phenoxy]-6-methyl-2,3-dihydro-1H-inden-4-yl]-3-oxopropanoic acid Traditional Name: 3-amino-2-[7-[4-hydroxy-3-(trifluoromethyl)phenoxy]-6-methyl-indan-4-yl]-3-keto-propionic acid Formula: C20H18F3NO5 MolecularWeight: 409.35583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(CCC2)C(=C1)C(C(=O)N)C(=O)O)OC3=CC(=C(C=C3)O)C(F)(F)F

Isomeric SMILES

CC1=C(C2=C(CCC2)C(=C1)C(C(=O)N)C(=O)O)OC3=CC(=C(C=C3)O)C(F)(F)F

InChI

InChI=1S/C20H18F3NO5/c1-9-7-13(16(18(24)26)19(27)28)11-3-2-4-12(11)17(9)29-10-5-6-15(25)14(8-10)20(21,22)23/h5-8,16,25H,2-4H2,1H3,(H2,24,26)(H,27,28)