methyl 2-[2-chloranylbutanoyl-(2,6-dimethylphenyl)amino]propanoate

Systemtic Name: methyl 2-[2-chloranylbutanoyl-(2,6-dimethylphenyl)amino]propanoate Openeye Name: methyl 2-[N-(2-chlorobutanoyl)-2,6-dimethyl-anilino]propanoate CAS Name: 2-(N-(2-chloro-1-oxobutyl)-2,6-dimethylanilino)propanoic acid methyl ester IUPAC Name: methyl 2-[N-(2-chlorobutanoyl)-2,6-dimethylanilino]propanoate Traditional Name: 2-[N-(2-chlorobutanoyl)-2,6-dimethyl-anilino]propionic acid methyl ester Formula: C16H22ClNO3 MolecularWeight: 311.80378

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N(C1=C(C=CC=C1C)C)C(C)C(=O)OC)Cl

Isomeric SMILES

CCC(C(=O)N(C1=C(C=CC=C1C)C)C(C)C(=O)OC)Cl

InChI

InChI=1S/C16H22ClNO3/c1-6-13(17)15(19)18(12(4)16(20)21-5)14-10(2)8-7-9-11(14)3/h7-9,12-13H,6H2,1-5H3