2-methyl-5-nitro-N-[3-(2-oxidanylideneazepan-1-yl)propyl]benzenesulfonamide

Systemtic Name: 2-methyl-5-nitro-N-[3-(2-oxidanylideneazepan-1-yl)propyl]benzenesulfonamide Openeye Name: 2-methyl-5-nitro-N-[3-(2-oxoazepan-1-yl)propyl]benzenesulfonamide CAS Name: 2-methyl-5-nitro-N-[3-(2-oxo-1-azepanyl)propyl]benzenesulfonamide IUPAC Name: 2-methyl-5-nitro-N-[3-(2-oxoazepan-1-yl)propyl]benzenesulfonamide Traditional Name: N-[3-(2-ketoazepan-1-yl)propyl]-2-methyl-5-nitro-benzenesulfonamide Formula: C16H23N3O5S MolecularWeight: 369.43592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCCCN2CCCCCC2=O

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCCCN2CCCCCC2=O

InChI

InChI=1S/C16H23N3O5S/c1-13-7-8-14(19(21)22)12-15(13)25(23,24)17-9-5-11-18-10-4-2-3-6-16(18)20/h7-8,12,17H,2-6,9-11H2,1H3