N-(3-iodanyl-4-methyl-phenyl)-1-(6-nitro-1,3-benzodioxol-5-yl)methanimine

Systemtic Name: N-(3-iodanyl-4-methyl-phenyl)-1-(6-nitro-1,3-benzodioxol-5-yl)methanimine Openeye Name: N-(3-iodo-4-methyl-phenyl)-1-(6-nitro-1,3-benzodioxol-5-yl)methanimine CAS Name: N-(3-iodo-4-methylphenyl)-1-(6-nitro-1,3-benzodioxol-5-yl)methanimine IUPAC Name: N-(3-iodo-4-methylphenyl)-1-(6-nitro-1,3-benzodioxol-5-yl)methanimine Traditional Name: (3-iodo-4-methyl-phenyl)-[(6-nitro-1,3-benzodioxol-5-yl)methylene]amine Formula: C15H11IN2O4 MolecularWeight: 410.16331

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N=CC2=CC3=C(C=C2[N+](=O)[O-])OCO3)I

Isomeric SMILES

CC1=C(C=C(C=C1)N=CC2=CC3=C(C=C2[N+](=O)[O-])OCO3)I

InChI

InChI=1S/C15H11IN2O4/c1-9-2-3-11(5-12(9)16)17-7-10-4-14-15(22-8-21-14)6-13(10)18(19)20/h2-7H,8H2,1H3