1-[(3-bromanyl-4-methoxy-phenyl)methyl]azepane

Systemtic Name: 1-[(3-bromanyl-4-methoxy-phenyl)methyl]azepane Openeye Name: 1-[(3-bromo-4-methoxy-phenyl)methyl]azepane CAS Name: 1-[(3-bromo-4-methoxyphenyl)methyl]azepane IUPAC Name: 1-[(3-bromo-4-methoxyphenyl)methyl]azepane Traditional Name: 1-(3-bromo-4-methoxy-benzyl)azepane Formula: C14H20BrNO MolecularWeight: 298.2187

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCCCCC2)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCCCCC2)Br

InChI

InChI=1S/C14H20BrNO/c1-17-14-7-6-12(10-13(14)15)11-16-8-4-2-3-5-9-16/h6-7,10H,2-5,8-9,11H2,1H3