4-[[2-(dimethylamino)-2-oxidanylidene-ethyl]-methyl-amino]-3-fluoranyl-benzoic acid

Systemtic Name: 4-[[2-(dimethylamino)-2-oxidanylidene-ethyl]-methyl-amino]-3-fluoranyl-benzoic acid Openeye Name: 4-[[2-(dimethylamino)-2-oxo-ethyl]-methyl-amino]-3-fluoro-benzoic acid CAS Name: 4-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-3-fluorobenzoic acid IUPAC Name: 4-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-3-fluorobenzoic acid Traditional Name: 4-[[2-(dimethylamino)-2-keto-ethyl]-methyl-amino]-3-fluoro-benzoic acid Formula: C12H15FN2O3 MolecularWeight: 254.257503

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CN(C)C1=C(C=C(C=C1)C(=O)O)F

Isomeric SMILES

CN(C)C(=O)CN(C)C1=C(C=C(C=C1)C(=O)O)F

InChI

InChI=1S/C12H15FN2O3/c1-14(2)11(16)7-15(3)10-5-4-8(12(17)18)6-9(10)13/h4-6H,7H2,1-3H3,(H,17,18)