(5E)-8-bromanyl-1-methyl-3,4-dihydro-2H-1-benzazocine-5-carboxylic acid

Systemtic Name: (5E)-8-bromanyl-1-methyl-3,4-dihydro-2H-1-benzazocine-5-carboxylic acid Openeye Name: (5E)-8-bromo-1-methyl-3,4-dihydro-2H-1-benzazocine-5-carboxylic acid CAS Name: (5E)-8-bromo-1-methyl-3,4-dihydro-2H-1-benzazocine-5-carboxylic acid IUPAC Name: (5E)-8-bromo-1-methyl-3,4-dihydro-2H-1-benzazocine-5-carboxylic acid Traditional Name: (5E)-8-bromo-1-methyl-3,4-dihydro-2H-1-benzazocine-5-carboxylic acid Formula: C13H14BrNO2 MolecularWeight: 296.15976

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC(=CC2=C1C=CC(=C2)Br)C(=O)O

Isomeric SMILES

CN1CCC/C(=C\C2=C1C=CC(=C2)Br)/C(=O)O

InChI

InChI=1S/C13H14BrNO2/c1-15-6-2-3-9(13(16)17)7-10-8-11(14)4-5-12(10)15/h4-5,7-8H,2-3,6H2,1H3,(H,16,17)/b9-7+