1,4-bis[(5-fluoranyl-2-methoxy-phenyl)sulfonyl]-1,4-diazepane

Systemtic Name: 1,4-bis[(5-fluoranyl-2-methoxy-phenyl)sulfonyl]-1,4-diazepane Openeye Name: 1,4-bis[(5-fluoro-2-methoxy-phenyl)sulfonyl]-1,4-diazepane CAS Name: 1,4-bis[(5-fluoro-2-methoxyphenyl)sulfonyl]-1,4-diazepane IUPAC Name: 1,4-bis[(5-fluoro-2-methoxyphenyl)sulfonyl]-1,4-diazepane Traditional Name: 1,4-bis[(5-fluoro-2-methoxy-phenyl)sulfonyl]-1,4-diazepane Formula: C19H22F2N2O6S2 MolecularWeight: 476.514586

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)S(=O)(=O)N2CCCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)F)S(=O)(=O)N2CCCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)F)OC

InChI

InChI=1S/C19H22F2N2O6S2/c1-28-16-6-4-14(20)12-18(16)30(24,25)22-8-3-9-23(11-10-22)31(26,27)19-13-15(21)5-7-17(19)29-2/h4-7,12-13H,3,8-11H2,1-2H3