1-(5-bromanyl-2-methoxy-phenyl)sulfonylazepane

Systemtic Name: 1-(5-bromanyl-2-methoxy-phenyl)sulfonylazepane Openeye Name: 1-(5-bromo-2-methoxy-phenyl)sulfonylazepane CAS Name: 1-(5-bromo-2-methoxyphenyl)sulfonylazepane IUPAC Name: 1-(5-bromo-2-methoxyphenyl)sulfonylazepane Traditional Name: 1-(5-bromo-2-methoxy-phenyl)sulfonylazepane Formula: C13H18BrNO3S MolecularWeight: 348.25592

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCCCCC2

Isomeric SMILES

COC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCCCCC2

InChI

InChI=1S/C13H18BrNO3S/c1-18-12-7-6-11(14)10-13(12)19(16,17)15-8-4-2-3-5-9-15/h6-7,10H,2-5,8-9H2,1H3