6-(cyclohexylmethylsulfanyl)-6-nitro-cyclohexa-2,4-dien-1-amine

Systemtic Name: 6-(cyclohexylmethylsulfanyl)-6-nitro-cyclohexa-2,4-dien-1-amine Openeye Name: 6-(cyclohexylmethylsulfanyl)-6-nitro-cyclohexa-2,4-dien-1-amine CAS Name: 6-(cyclohexylmethylthio)-6-nitro-1-cyclohexa-2,4-dienamine IUPAC Name: 6-(cyclohexylmethylsulfanyl)-6-nitrocyclohexa-2,4-dien-1-amine Traditional Name: [6-(cyclohexylmethylthio)-6-nitro-cyclohexa-2,4-dien-1-yl]amine Formula: C13H20N2O2S MolecularWeight: 268.3751

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CSC2(C=CC=CC2N)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)CSC2(C=CC=CC2N)[N+](=O)[O-]

InChI

InChI=1S/C13H20N2O2S/c14-12-8-4-5-9-13(12,15(16)17)18-10-11-6-2-1-3-7-11/h4-5,8-9,11-12H,1-3,6-7,10,14H2