7-bromanyl-1-methyl-2,3-dihydro-1-benzazepine-4-carboxylic acid

Systemtic Name: 7-bromanyl-1-methyl-2,3-dihydro-1-benzazepine-4-carboxylic acid Openeye Name: 7-bromo-1-methyl-2,3-dihydro-1-benzazepine-4-carboxylic acid CAS Name: 7-bromo-1-methyl-2,3-dihydro-1-benzazepine-4-carboxylic acid IUPAC Name: 7-bromo-1-methyl-2,3-dihydro-1-benzazepine-4-carboxylic acid Traditional Name: 7-bromo-1-methyl-2,3-dihydro-1-benzazepine-4-carboxylic acid Formula: C12H12BrNO2 MolecularWeight: 282.13318

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(=CC2=C1C=CC(=C2)Br)C(=O)O

Isomeric SMILES

CN1CCC(=CC2=C1C=CC(=C2)Br)C(=O)O

InChI

InChI=1S/C12H12BrNO2/c1-14-5-4-8(12(15)16)6-9-7-10(13)2-3-11(9)14/h2-3,6-7H,4-5H2,1H3,(H,15,16)