N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-N-(3-chloranyl-4-methoxy-phenyl)methanesulfonamide

Systemtic Name: N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-N-(3-chloranyl-4-methoxy-phenyl)methanesulfonamide Openeye Name: N-[2-(azepan-1-yl)-2-oxo-ethyl]-N-(3-chloro-4-methoxy-phenyl)methanesulfonamide CAS Name: N-[2-(1-azepanyl)-2-oxoethyl]-N-(3-chloro-4-methoxyphenyl)methanesulfonamide IUPAC Name: N-[2-(azepan-1-yl)-2-oxoethyl]-N-(3-chloro-4-methoxyphenyl)methanesulfonamide Traditional Name: N-[2-(azepan-1-yl)-2-keto-ethyl]-N-(3-chloro-4-methoxy-phenyl)methanesulfonamide Formula: C16H23ClN2O4S MolecularWeight: 374.88282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N(CC(=O)N2CCCCCC2)S(=O)(=O)C)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)N(CC(=O)N2CCCCCC2)S(=O)(=O)C)Cl

InChI

InChI=1S/C16H23ClN2O4S/c1-23-15-8-7-13(11-14(15)17)19(24(2,21)22)12-16(20)18-9-5-3-4-6-10-18/h7-8,11H,3-6,9-10,12H2,1-2H3