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

Systemtic Name: methyl 2-[[3,5-bis(bromanyl)-4-(4-oxidanyl-3-propan-2-yl-phenoxy)phenyl]amino]-2-oxidanylidene-ethanoate Openeye Name: methyl 2-[3,5-dibromo-4-(4-hydroxy-3-isopropyl-phenoxy)anilino]-2-oxo-acetate CAS Name: 2-[3,5-dibromo-4-(4-hydroxy-3-propan-2-ylphenoxy)anilino]-2-oxoacetic acid methyl ester IUPAC Name: methyl 2-[3,5-dibromo-4-(4-hydroxy-3-propan-2-ylphenoxy)anilino]-2-oxoacetate Traditional Name: 2-[3,5-dibromo-4-(4-hydroxy-3-isopropyl-phenoxy)anilino]-2-keto-acetic acid methyl ester Formula: C18H17Br2NO5 MolecularWeight: 487.13928

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CC(=C1)OC2=C(C=C(C=C2Br)NC(=O)C(=O)OC)Br)O

Isomeric SMILES

CC(C)C1=C(C=CC(=C1)OC2=C(C=C(C=C2Br)NC(=O)C(=O)OC)Br)O

InChI

InChI=1S/C18H17Br2NO5/c1-9(2)12-8-11(4-5-15(12)22)26-16-13(19)6-10(7-14(16)20)21-17(23)18(24)25-3/h4-9,22H,1-3H3,(H,21,23)