(3,3-dimethyl-2-oxidanylidene-butyl) 2-azanyl-4-chloranyl-benzoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2-azanyl-4-chloranyl-benzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2-amino-4-chloro-benzoate CAS Name: 2-amino-4-chlorobenzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2-amino-4-chlorobenzoate Traditional Name: 2-amino-4-chloro-benzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C13H16ClNO3 MolecularWeight: 269.72404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=C(C=C(C=C1)Cl)N

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=C(C=C(C=C1)Cl)N

InChI

InChI=1S/C13H16ClNO3/c1-13(2,3)11(16)7-18-12(17)9-5-4-8(14)6-10(9)15/h4-6H,7,15H2,1-3H3