azepan-1-yl-[3-bromanyl-4-(2-methoxyethoxy)phenyl]methanone

Systemtic Name: azepan-1-yl-[3-bromanyl-4-(2-methoxyethoxy)phenyl]methanone Openeye Name: azepan-1-yl-[3-bromo-4-(2-methoxyethoxy)phenyl]methanone CAS Name: 1-azepanyl-[3-bromo-4-(2-methoxyethoxy)phenyl]methanone IUPAC Name: azepan-1-yl-[3-bromo-4-(2-methoxyethoxy)phenyl]methanone Traditional Name: azepan-1-yl-[3-bromo-4-(2-methoxyethoxy)phenyl]methanone Formula: C16H22BrNO3 MolecularWeight: 356.25478

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C=C1)C(=O)N2CCCCCC2)Br

Isomeric SMILES

COCCOC1=C(C=C(C=C1)C(=O)N2CCCCCC2)Br

InChI

InChI=1S/C16H22BrNO3/c1-20-10-11-21-15-7-6-13(12-14(15)17)16(19)18-8-4-2-3-5-9-18/h6-7,12H,2-5,8-11H2,1H3