1-bromanyl-6-[[4-(2,2-dimethylpropanoyl)phenyl]carbonylamino]cyclohexa-2,4-diene-1-carboxylic acid

Systemtic Name: 1-bromanyl-6-[[4-(2,2-dimethylpropanoyl)phenyl]carbonylamino]cyclohexa-2,4-diene-1-carboxylic acid Openeye Name: 1-bromo-6-[[4-(2,2-dimethylpropanoyl)benzoyl]amino]cyclohexa-2,4-diene-1-carboxylic acid CAS Name: 1-bromo-6-[[[4-(2,2-dimethyl-1-oxopropyl)phenyl]-oxomethyl]amino]-1-cyclohexa-2,4-dienecarboxylic acid IUPAC Name: 1-bromo-6-[[4-(2,2-dimethylpropanoyl)benzoyl]amino]cyclohexa-2,4-diene-1-carboxylic acid Traditional Name: 1-bromo-6-[(4-pivaloylbenzoyl)amino]cyclohexa-2,4-diene-1-carboxylic acid Formula: C19H20BrNO4 MolecularWeight: 406.2704

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C1=CC=C(C=C1)C(=O)NC2C=CC=CC2(C(=O)O)Br

Isomeric SMILES

CC(C)(C)C(=O)C1=CC=C(C=C1)C(=O)NC2C=CC=CC2(C(=O)O)Br

InChI

InChI=1S/C19H20BrNO4/c1-18(2,3)15(22)12-7-9-13(10-8-12)16(23)21-14-6-4-5-11-19(14,20)17(24)25/h4-11,14H,1-3H3,(H,21,23)(H,24,25)