4-[(2-chloranyl-6-fluoranyl-phenyl)methyl-methyl-amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(2-chloranyl-6-fluoranyl-phenyl)methyl-methyl-amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[(2-chloro-6-fluoro-phenyl)methyl-methyl-amino]-4-oxo-butanoic acid CAS Name: 4-[(2-chloro-6-fluorophenyl)methyl-methylamino]-4-oxobutanoic acid IUPAC Name: 4-[(2-chloro-6-fluorophenyl)methyl-methylamino]-4-oxobutanoic acid Traditional Name: 4-[(2-chloro-6-fluoro-benzyl)-methyl-amino]-4-keto-butyric acid Formula: C12H13ClFNO3 MolecularWeight: 273.687923

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC=C1Cl)F)C(=O)CCC(=O)O

Isomeric SMILES

CN(CC1=C(C=CC=C1Cl)F)C(=O)CCC(=O)O

InChI

InChI=1S/C12H13ClFNO3/c1-15(11(16)5-6-12(17)18)7-8-9(13)3-2-4-10(8)14/h2-4H,5-7H2,1H3,(H,17,18)