2-[[2-[(3-chloranyl-4-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]amino]-3-methyl-butanoic acid

Systemtic Name: 2-[[2-[(3-chloranyl-4-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]amino]-3-methyl-butanoic acid Openeye Name: 2-[[2-(3-chloro-4-fluoro-anilino)-2-oxo-ethyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-(3-chloro-4-fluoro-anilino)-2-keto-ethyl]amino]-3-methyl-butyric acid Formula: C13H16ClFN2O3 MolecularWeight: 302.729143

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NCC(=O)NC1=CC(=C(C=C1)F)Cl

Isomeric SMILES

CC(C)C(C(=O)O)NCC(=O)NC1=CC(=C(C=C1)F)Cl

InChI

InChI=1S/C13H16ClFN2O3/c1-7(2)12(13(19)20)16-6-11(18)17-8-3-4-10(15)9(14)5-8/h3-5,7,12,16H,6H2,1-2H3,(H,17,18)(H,19,20)