2-[[4-(3-bromanyl-4-oxidanyl-phenoxy)-3,5-dimethyl-phenyl]amino]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[[4-(3-bromanyl-4-oxidanyl-phenoxy)-3,5-dimethyl-phenyl]amino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[4-(3-bromo-4-hydroxy-phenoxy)-3,5-dimethyl-anilino]-2-oxo-acetic acid CAS Name: 2-[4-(3-bromo-4-hydroxyphenoxy)-3,5-dimethylanilino]-2-oxoacetic acid IUPAC Name: 2-[4-(3-bromo-4-hydroxyphenoxy)-3,5-dimethylanilino]-2-oxoacetic acid Traditional Name: 2-[4-(3-bromo-4-hydroxy-phenoxy)-3,5-dimethyl-anilino]-2-keto-acetic acid Formula: C16H14BrNO5 MolecularWeight: 380.19006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC2=CC(=C(C=C2)O)Br)C)NC(=O)C(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1OC2=CC(=C(C=C2)O)Br)C)NC(=O)C(=O)O

InChI

InChI=1S/C16H14BrNO5/c1-8-5-10(18-15(20)16(21)22)6-9(2)14(8)23-11-3-4-13(19)12(17)7-11/h3-7,19H,1-2H3,(H,18,20)(H,21,22)