N-cycloheptylsulfanyl-N-ethyl-2,4-dinitro-aniline

Systemtic Name: N-cycloheptylsulfanyl-N-ethyl-2,4-dinitro-aniline Openeye Name: N-cycloheptylsulfanyl-N-ethyl-2,4-dinitro-aniline CAS Name: N-(2,4-dinitrophenyl)-N-ethylcycloheptanesulfenamide IUPAC Name: N-cycloheptylsulfanyl-N-ethyl-2,4-dinitroaniline Traditional Name: (cycloheptylthio)-(2,4-dinitrophenyl)-ethyl-amine Formula: C15H21N3O4S MolecularWeight: 339.40994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])SC2CCCCCC2

Isomeric SMILES

CCN(C1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])SC2CCCCCC2

InChI

InChI=1S/C15H21N3O4S/c1-2-16(23-13-7-5-3-4-6-8-13)14-10-9-12(17(19)20)11-15(14)18(21)22/h9-11,13H,2-8H2,1H3