4-bromanyl-2-[[4-(2,2-dimethylpropanoylamino)phenyl]carbonylamino]benzoic acid

Systemtic Name: 4-bromanyl-2-[[4-(2,2-dimethylpropanoylamino)phenyl]carbonylamino]benzoic acid Openeye Name: 4-bromo-2-[[4-(2,2-dimethylpropanoylamino)benzoyl]amino]benzoic acid CAS Name: 4-bromo-2-[[[4-[(2,2-dimethyl-1-oxopropyl)amino]phenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 4-bromo-2-[[4-(2,2-dimethylpropanoylamino)benzoyl]amino]benzoic acid Traditional Name: 4-bromo-2-[[4-(pivaloylamino)benzoyl]amino]benzoic acid Formula: C19H19BrN2O4 MolecularWeight: 419.26916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)Br)C(=O)O

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)Br)C(=O)O

InChI

InChI=1S/C19H19BrN2O4/c1-19(2,3)18(26)21-13-7-4-11(5-8-13)16(23)22-15-10-12(20)6-9-14(15)17(24)25/h4-10H,1-3H3,(H,21,26)(H,22,23)(H,24,25)