azepan-1-yl-(5-bromanyl-2-oxidanyl-phenyl)methanone

Systemtic Name: azepan-1-yl-(5-bromanyl-2-oxidanyl-phenyl)methanone Openeye Name: azepan-1-yl-(5-bromo-2-hydroxy-phenyl)methanone CAS Name: 1-azepanyl-(5-bromo-2-hydroxyphenyl)methanone IUPAC Name: azepan-1-yl-(5-bromo-2-hydroxyphenyl)methanone Traditional Name: azepan-1-yl-(5-bromo-2-hydroxy-phenyl)methanone Formula: C13H16BrNO2 MolecularWeight: 298.17564

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=C(C=CC(=C2)Br)O

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=C(C=CC(=C2)Br)O

InChI

InChI=1S/C13H16BrNO2/c14-10-5-6-12(16)11(9-10)13(17)15-7-3-1-2-4-8-15/h5-6,9,16H,1-4,7-8H2