3-[bis(azanyl)methylidene]-1,1-dimethyl-guanidine; 2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanamide

Systemtic Name: 3-[bis(azanyl)methylidene]-1,1-dimethyl-guanidine; 2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanamide Openeye Name: 3-(diaminomethylene)-1,1-dimethyl-guanidine; 2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanamide CAS Name: 3-(diaminomethylidene)-1,1-dimethylguanidine; 2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanamide IUPAC Name: 3-(diaminomethylidene)-1,1-dimethylguanidine; 2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanamide Traditional Name: 3-(diaminomethylene)-1,1-dimethyl-guanidine; 2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propionamide Formula: C15H22F3N7O3 MolecularWeight: 405.37549

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC(=C(C=C1)[N+](=O)[O-])C(F)(F)F.CN(C)C(=N)N=C(N)N

Isomeric SMILES

CC(C)C(=O)NC1=CC(=C(C=C1)[N+](=O)[O-])C(F)(F)F.CN(C)C(=N)N=C(N)N

InChI

InChI=1S/C11H11F3N2O3.C4H11N5/c1-6(2)10(17)15-7-3-4-9(16(18)19)8(5-7)11(12,13)14;1-9(2)4(7)8-3(5)6/h3-6H,1-2H3,(H,15,17);1-2H3,(H5,5,6,7,8)