1-(4-bromanyl-3-pentoxy-phenyl)sulfonylazepane

Systemtic Name: 1-(4-bromanyl-3-pentoxy-phenyl)sulfonylazepane Openeye Name: 1-(4-bromo-3-pentoxy-phenyl)sulfonylazepane CAS Name: 1-(4-bromo-3-pentoxyphenyl)sulfonylazepane IUPAC Name: 1-(4-bromo-3-pentoxyphenyl)sulfonylazepane Traditional Name: 1-(3-amoxy-4-bromo-phenyl)sulfonylazepane Formula: C17H26BrNO3S MolecularWeight: 404.36224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=CC(=C1)S(=O)(=O)N2CCCCCC2)Br

Isomeric SMILES

CCCCCOC1=C(C=CC(=C1)S(=O)(=O)N2CCCCCC2)Br

InChI

InChI=1S/C17H26BrNO3S/c1-2-3-8-13-22-17-14-15(9-10-16(17)18)23(20,21)19-11-6-4-5-7-12-19/h9-10,14H,2-8,11-13H2,1H3