1-[4-(2-chloranyl-4-fluoranyl-phenyl)sulfonyl-1,4-diazepan-1-yl]ethanone

Systemtic Name: 1-[4-(2-chloranyl-4-fluoranyl-phenyl)sulfonyl-1,4-diazepan-1-yl]ethanone Openeye Name: 1-[4-(2-chloro-4-fluoro-phenyl)sulfonyl-1,4-diazepan-1-yl]ethanone CAS Name: 1-[4-(2-chloro-4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]ethanone IUPAC Name: 1-[4-(2-chloro-4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]ethanone Traditional Name: 1-[4-(2-chloro-4-fluoro-phenyl)sulfonyl-1,4-diazepan-1-yl]ethanone Formula: C13H16ClFN2O3S MolecularWeight: 334.794143

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16ClFN2O3S/c1-10(18)16-5-2-6-17(8-7-16)21(19,20)13-4-3-11(15)9-12(13)14/h3-4,9H,2,5-8H2,1H3