N-[(2-chloranyl-5-nitro-phenyl)methyl]-N-methyl-azepane-1-sulfonamide

Systemtic Name: N-[(2-chloranyl-5-nitro-phenyl)methyl]-N-methyl-azepane-1-sulfonamide Openeye Name: N-[(2-chloro-5-nitro-phenyl)methyl]-N-methyl-azepane-1-sulfonamide CAS Name: N-[(2-chloro-5-nitrophenyl)methyl]-N-methyl-1-azepanesulfonamide IUPAC Name: N-[(2-chloro-5-nitrophenyl)methyl]-N-methylazepane-1-sulfonamide Traditional Name: N-(2-chloro-5-nitro-benzyl)-N-methyl-azepane-1-sulfonamide Formula: C14H20ClN3O4S MolecularWeight: 361.8443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)S(=O)(=O)N2CCCCCC2

Isomeric SMILES

CN(CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)S(=O)(=O)N2CCCCCC2

InChI

InChI=1S/C14H20ClN3O4S/c1-16(23(21,22)17-8-4-2-3-5-9-17)11-12-10-13(18(19)20)6-7-14(12)15/h6-7,10H,2-5,8-9,11H2,1H3