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

Systemtic Name: 2-[2-(4-chloranyl-3-methyl-phenoxy)ethanoylamino]-3-methyl-butanoic acid Openeye Name: 2-[[2-(4-chloro-3-methyl-phenoxy)acetyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[2-(4-chloro-3-methylphenoxy)-1-oxoethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-(4-chloro-3-methyl-phenoxy)acetyl]amino]-3-methyl-butyric acid Formula: C14H18ClNO4 MolecularWeight: 299.75002

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18ClNO4/c1-8(2)13(14(18)19)16-12(17)7-20-10-4-5-11(15)9(3)6-10/h4-6,8,13H,7H2,1-3H3,(H,16,17)(H,18,19)