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

Systemtic Name: 4-bromanyl-2-[[2-(dimethylamino)-2-oxidanylidene-ethyl]-methyl-amino]benzoic acid Openeye Name: 4-bromo-2-[[2-(dimethylamino)-2-oxo-ethyl]-methyl-amino]benzoic acid CAS Name: 4-bromo-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]benzoic acid IUPAC Name: 4-bromo-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]benzoic acid Traditional Name: 4-bromo-2-[[2-(dimethylamino)-2-keto-ethyl]-methyl-amino]benzoic acid Formula: C12H15BrN2O3 MolecularWeight: 315.1631

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CN(C)C1=C(C=CC(=C1)Br)C(=O)O

Isomeric SMILES

CN(C)C(=O)CN(C)C1=C(C=CC(=C1)Br)C(=O)O

InChI

InChI=1S/C12H15BrN2O3/c1-14(2)11(16)7-15(3)10-6-8(13)4-5-9(10)12(17)18/h4-6H,7H2,1-3H3,(H,17,18)