2-[2-(2-chloranyl-4-methyl-phenyl)ethanoylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[2-(2-chloranyl-4-methyl-phenyl)ethanoylamino]-3-methyl-butanoic acid Openeye Name: 2-[[2-(2-chloro-4-methyl-phenyl)acetyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[2-(2-chloro-4-methylphenyl)-1-oxoethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[2-(2-chloro-4-methylphenyl)acetyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-(2-chloro-4-methyl-phenyl)acetyl]amino]-3-methyl-butyric acid Formula: C14H18ClNO3 MolecularWeight: 283.75062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CC(=O)NC(C(C)C)C(=O)O)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)CC(=O)NC(C(C)C)C(=O)O)Cl

InChI

InChI=1S/C14H18ClNO3/c1-8(2)13(14(18)19)16-12(17)7-10-5-4-9(3)6-11(10)15/h4-6,8,13H,7H2,1-3H3,(H,16,17)(H,18,19)