1-[(5-bromanylpyridin-3-yl)methyl]-3-methyl-azepan-2-one

Systemtic Name: 1-[(5-bromanylpyridin-3-yl)methyl]-3-methyl-azepan-2-one Openeye Name: 1-[(5-bromo-3-pyridyl)methyl]-3-methyl-azepan-2-one CAS Name: 1-[(5-bromo-3-pyridinyl)methyl]-3-methyl-2-azepanone IUPAC Name: 1-[(5-bromopyridin-3-yl)methyl]-3-methylazepan-2-one Traditional Name: 1-[(5-bromo-3-pyridyl)methyl]-3-methyl-azepan-2-one Formula: C13H17BrN2O MolecularWeight: 297.19088

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN(C1=O)CC2=CC(=CN=C2)Br

Isomeric SMILES

CC1CCCCN(C1=O)CC2=CC(=CN=C2)Br

InChI

InChI=1S/C13H17BrN2O/c1-10-4-2-3-5-16(13(10)17)9-11-6-12(14)8-15-7-11/h6-8,10H,2-5,9H2,1H3