4-bromanyl-2-[ethyl(2-methylprop-2-enyl)amino]benzoic acid

Systemtic Name: 4-bromanyl-2-[ethyl(2-methylprop-2-enyl)amino]benzoic acid Openeye Name: 4-bromo-2-[ethyl(2-methylallyl)amino]benzoic acid CAS Name: 4-bromo-2-[ethyl(2-methylprop-2-enyl)amino]benzoic acid IUPAC Name: 4-bromo-2-[ethyl(2-methylprop-2-enyl)amino]benzoic acid Traditional Name: 4-bromo-2-[ethyl(2-methylallyl)amino]benzoic acid Formula: C13H16BrNO2 MolecularWeight: 298.17564

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16BrNO2/c1-4-15(8-9(2)3)12-7-10(14)5-6-11(12)13(16)17/h5-7H,2,4,8H2,1,3H3,(H,16,17)