1-[4-[3,4-bis(fluoranyl)phenyl]sulfonyl-1,4-diazepan-1-yl]ethanone

Systemtic Name: 1-[4-[3,4-bis(fluoranyl)phenyl]sulfonyl-1,4-diazepan-1-yl]ethanone Openeye Name: 1-[4-(3,4-difluorophenyl)sulfonyl-1,4-diazepan-1-yl]ethanone CAS Name: 1-[4-(3,4-difluorophenyl)sulfonyl-1,4-diazepan-1-yl]ethanone IUPAC Name: 1-[4-(3,4-difluorophenyl)sulfonyl-1,4-diazepan-1-yl]ethanone Traditional Name: 1-[4-(3,4-difluorophenyl)sulfonyl-1,4-diazepan-1-yl]ethanone Formula: C13H16F2N2O3S MolecularWeight: 318.339546

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)F)F

Isomeric SMILES

CC(=O)N1CCCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)F)F

InChI

InChI=1S/C13H16F2N2O3S/c1-10(18)16-5-2-6-17(8-7-16)21(19,20)11-3-4-12(14)13(15)9-11/h3-4,9H,2,5-8H2,1H3