methyl 5-(2,2-dimethylpropanoylamino)-2-fluoranyl-benzoate

Systemtic Name: methyl 5-(2,2-dimethylpropanoylamino)-2-fluoranyl-benzoate Openeye Name: methyl 5-(2,2-dimethylpropanoylamino)-2-fluoro-benzoate CAS Name: 5-[(2,2-dimethyl-1-oxopropyl)amino]-2-fluorobenzoic acid methyl ester IUPAC Name: methyl 5-(2,2-dimethylpropanoylamino)-2-fluorobenzoate Traditional Name: 2-fluoro-5-(pivaloylamino)benzoic acid methyl ester Formula: C13H16FNO3 MolecularWeight: 253.269443

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC(=C(C=C1)F)C(=O)OC

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC(=C(C=C1)F)C(=O)OC

InChI

InChI=1S/C13H16FNO3/c1-13(2,3)12(17)15-8-5-6-10(14)9(7-8)11(16)18-4/h5-7H,1-4H3,(H,15,17)