2-[2-chloranylethanoyl-(2-ethyl-6-methyl-phenyl)amino]-3-methyl-butanoic acid

Systemtic Name: 2-[2-chloranylethanoyl-(2-ethyl-6-methyl-phenyl)amino]-3-methyl-butanoic acid Openeye Name: 2-(N-(2-chloroacetyl)-2-ethyl-6-methyl-anilino)-3-methyl-butanoic acid CAS Name: 2-(N-(2-chloro-1-oxoethyl)-2-ethyl-6-methylanilino)-3-methylbutanoic acid IUPAC Name: 2-(N-(2-chloroacetyl)-2-ethyl-6-methylanilino)-3-methylbutanoic acid Traditional Name: 2-(N-(2-chloroacetyl)-2-ethyl-6-methyl-anilino)-3-methyl-butyric acid Formula: C16H22ClNO3 MolecularWeight: 311.80378

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1N(C(C(C)C)C(=O)O)C(=O)CCl)C

Isomeric SMILES

CCC1=CC=CC(=C1N(C(C(C)C)C(=O)O)C(=O)CCl)C

InChI

InChI=1S/C16H22ClNO3/c1-5-12-8-6-7-11(4)15(12)18(13(19)9-17)14(10(2)3)16(20)21/h6-8,10,14H,5,9H2,1-4H3,(H,20,21)