(2-cyclohexylsulfanyl-5-nitro-phenyl)methylidene-(phenylmethyl)azanium

Systemtic Name: (2-cyclohexylsulfanyl-5-nitro-phenyl)methylidene-(phenylmethyl)azanium Openeye Name: benzyl-[(2-cyclohexylsulfanyl-5-nitro-phenyl)methylene]ammonium CAS Name: [2-(cyclohexylthio)-5-nitrophenyl]methylidene-(phenylmethyl)ammonium IUPAC Name: benzyl-[(2-cyclohexylsulfanyl-5-nitrophenyl)methylidene]azanium Traditional Name: benzyl-[2-(cyclohexylthio)-5-nitro-benzylidene]ammonium Formula: C20H23N2O2S+ MolecularWeight: 355.47382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)SC2=C(C=C(C=C2)[N+](=O)[O-])C=[NH+]CC3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)SC2=C(C=C(C=C2)[N+](=O)[O-])C=[NH+]CC3=CC=CC=C3

InChI

InChI=1S/C20H22N2O2S/c23-22(24)18-11-12-20(25-19-9-5-2-6-10-19)17(13-18)15-21-14-16-7-3-1-4-8-16/h1,3-4,7-8,11-13,15,19H,2,5-6,9-10,14H2/p+1