3-chloranyl-5-(2,2-dimethylpropanoylamino)-4-methoxy-benzoate

Systemtic Name: 3-chloranyl-5-(2,2-dimethylpropanoylamino)-4-methoxy-benzoate Openeye Name: 3-chloro-5-(2,2-dimethylpropanoylamino)-4-methoxy-benzoate CAS Name: 3-chloro-5-[(2,2-dimethyl-1-oxopropyl)amino]-4-methoxybenzoate IUPAC Name: 3-chloro-5-(2,2-dimethylpropanoylamino)-4-methoxybenzoate Traditional Name: 3-chloro-4-methoxy-5-(pivaloylamino)benzoate Formula: C13H15ClNO4- MolecularWeight: 284.7155

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=C(C(=CC(=C1)C(=O)[O-])Cl)OC

Isomeric SMILES

CC(C)(C)C(=O)NC1=C(C(=CC(=C1)C(=O)[O-])Cl)OC

InChI

InChI=1S/C13H16ClNO4/c1-13(2,3)12(18)15-9-6-7(11(16)17)5-8(14)10(9)19-4/h5-6H,1-4H3,(H,15,18)(H,16,17)/p-1