1-(4-bromanyl-2,5-dimethoxy-phenyl)sulfonylazepane

Systemtic Name: 1-(4-bromanyl-2,5-dimethoxy-phenyl)sulfonylazepane Openeye Name: 1-(4-bromo-2,5-dimethoxy-phenyl)sulfonylazepane CAS Name: 1-(4-bromo-2,5-dimethoxyphenyl)sulfonylazepane IUPAC Name: 1-(4-bromo-2,5-dimethoxyphenyl)sulfonylazepane Traditional Name: 1-(4-bromo-2,5-dimethoxy-phenyl)sulfonylazepane Formula: C14H20BrNO4S MolecularWeight: 378.2819

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1Br)OC)S(=O)(=O)N2CCCCCC2

Isomeric SMILES

COC1=CC(=C(C=C1Br)OC)S(=O)(=O)N2CCCCCC2

InChI

InChI=1S/C14H20BrNO4S/c1-19-12-10-14(13(20-2)9-11(12)15)21(17,18)16-7-5-3-4-6-8-16/h9-10H,3-8H2,1-2H3