1,4-bis[[3,4-bis(fluoranyl)phenyl]sulfonyl]-1,4-diazepane

Systemtic Name: 1,4-bis[[3,4-bis(fluoranyl)phenyl]sulfonyl]-1,4-diazepane Openeye Name: 1,4-bis[(3,4-difluorophenyl)sulfonyl]-1,4-diazepane CAS Name: 1,4-bis[(3,4-difluorophenyl)sulfonyl]-1,4-diazepane IUPAC Name: 1,4-bis[(3,4-difluorophenyl)sulfonyl]-1,4-diazepane Traditional Name: 1,4-bis[(3,4-difluorophenyl)sulfonyl]-1,4-diazepane Formula: C17H16F4N2O4S2 MolecularWeight: 452.443553

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)F)F)S(=O)(=O)C3=CC(=C(C=C3)F)F

Isomeric SMILES

C1CN(CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)F)F)S(=O)(=O)C3=CC(=C(C=C3)F)F

InChI

InChI=1S/C17H16F4N2O4S2/c18-14-4-2-12(10-16(14)20)28(24,25)22-6-1-7-23(9-8-22)29(26,27)13-3-5-15(19)17(21)11-13/h2-5,10-11H,1,6-9H2