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

Systemtic Name: 4-bromanyl-2-[methyl-[2-(methylamino)-2-oxidanylidene-ethyl]amino]benzoic acid Openeye Name: 4-bromo-2-[methyl-[2-(methylamino)-2-oxo-ethyl]amino]benzoic acid CAS Name: 4-bromo-2-[methyl-[2-(methylamino)-2-oxoethyl]amino]benzoic acid IUPAC Name: 4-bromo-2-[methyl-[2-(methylamino)-2-oxoethyl]amino]benzoic acid Traditional Name: 4-bromo-2-[[2-keto-2-(methylamino)ethyl]-methyl-amino]benzoic acid Formula: C11H13BrN2O3 MolecularWeight: 301.13652

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13BrN2O3/c1-13-10(15)6-14(2)9-5-7(12)3-4-8(9)11(16)17/h3-5H,6H2,1-2H3,(H,13,15)(H,16,17)