1-(2-chloranyl-6-methyl-4-methylsulfonyl-phenyl)-1,4-diazepane

Systemtic Name: 1-(2-chloranyl-6-methyl-4-methylsulfonyl-phenyl)-1,4-diazepane Openeye Name: 1-(2-chloro-6-methyl-4-methylsulfonyl-phenyl)-1,4-diazepane CAS Name: 1-(2-chloro-6-methyl-4-methylsulfonylphenyl)-1,4-diazepane IUPAC Name: 1-(2-chloro-6-methyl-4-methylsulfonylphenyl)-1,4-diazepane Traditional Name: 1-(2-chloro-4-mesyl-6-methyl-phenyl)-1,4-diazepane Formula: C13H19ClN2O2S MolecularWeight: 302.82016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1N2CCCNCC2)Cl)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=CC(=C1N2CCCNCC2)Cl)S(=O)(=O)C

InChI

InChI=1S/C13H19ClN2O2S/c1-10-8-11(19(2,17)18)9-12(14)13(10)16-6-3-4-15-5-7-16/h8-9,15H,3-7H2,1-2H3