N-cyclohexylsulfanyl-N-methyl-2,4-dinitro-aniline

Systemtic Name: N-cyclohexylsulfanyl-N-methyl-2,4-dinitro-aniline Openeye Name: N-cyclohexylsulfanyl-N-methyl-2,4-dinitro-aniline CAS Name: N-(2,4-dinitrophenyl)-N-methylcyclohexanesulfenamide IUPAC Name: N-cyclohexylsulfanyl-N-methyl-2,4-dinitroaniline Traditional Name: (cyclohexylthio)-(2,4-dinitrophenyl)-methyl-amine Formula: C13H17N3O4S MolecularWeight: 311.35678

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])SC2CCCCC2

Isomeric SMILES

CN(C1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])SC2CCCCC2

InChI

InChI=1S/C13H17N3O4S/c1-14(21-11-5-3-2-4-6-11)12-8-7-10(15(17)18)9-13(12)16(19)20/h7-9,11H,2-6H2,1H3