azepan-1-yl-(2-chloranyl-5-methylsulfonyl-phenyl)methanone

Systemtic Name: azepan-1-yl-(2-chloranyl-5-methylsulfonyl-phenyl)methanone Openeye Name: azepan-1-yl-(2-chloro-5-methylsulfonyl-phenyl)methanone CAS Name: 1-azepanyl-(2-chloro-5-methylsulfonylphenyl)methanone IUPAC Name: azepan-1-yl-(2-chloro-5-methylsulfonylphenyl)methanone Traditional Name: azepan-1-yl-(2-chloro-5-mesyl-phenyl)methanone Formula: C14H18ClNO3S MolecularWeight: 315.81562

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)N2CCCCCC2

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)N2CCCCCC2

InChI

InChI=1S/C14H18ClNO3S/c1-20(18,19)11-6-7-13(15)12(10-11)14(17)16-8-4-2-3-5-9-16/h6-7,10H,2-5,8-9H2,1H3