methyl 2-[[3,5-bis(bromanyl)-4-(2-ethyl-4-oxidanyl-5-propan-2-yl-phenoxy)phenyl]amino]-2-oxidanylidene-ethanoate

Systemtic Name: methyl 2-[[3,5-bis(bromanyl)-4-(2-ethyl-4-oxidanyl-5-propan-2-yl-phenoxy)phenyl]amino]-2-oxidanylidene-ethanoate Openeye Name: methyl 2-[3,5-dibromo-4-(2-ethyl-4-hydroxy-5-isopropyl-phenoxy)anilino]-2-oxo-acetate CAS Name: 2-[3,5-dibromo-4-(2-ethyl-4-hydroxy-5-propan-2-ylphenoxy)anilino]-2-oxoacetic acid methyl ester IUPAC Name: methyl 2-[3,5-dibromo-4-(2-ethyl-4-hydroxy-5-propan-2-ylphenoxy)anilino]-2-oxoacetate Traditional Name: 2-[3,5-dibromo-4-(2-ethyl-4-hydroxy-5-isopropyl-phenoxy)anilino]-2-keto-acetic acid methyl ester Formula: C20H21Br2NO5 MolecularWeight: 515.19244

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1OC2=C(C=C(C=C2Br)NC(=O)C(=O)OC)Br)C(C)C)O

Isomeric SMILES

CCC1=CC(=C(C=C1OC2=C(C=C(C=C2Br)NC(=O)C(=O)OC)Br)C(C)C)O

InChI

InChI=1S/C20H21Br2NO5/c1-5-11-6-16(24)13(10(2)3)9-17(11)28-18-14(21)7-12(8-15(18)22)23-19(25)20(26)27-4/h6-10,24H,5H2,1-4H3,(H,23,25)