3-azabicyclo[2.2.1]hepta-1,3,5-triene; N-chloranyl-N,1-dimethyl-3-nitro-pyrrol-2-amine

Systemtic Name: 3-azabicyclo[2.2.1]hepta-1,3,5-triene; N-chloranyl-N,1-dimethyl-3-nitro-pyrrol-2-amine Openeye Name: 3-azabicyclo[2.2.1]hepta-1,3,5-triene; N-chloro-N,1-dimethyl-3-nitro-pyrrol-2-amine CAS Name: 3-azabicyclo[2.2.1]hepta-1,3,5-triene; N-chloro-N,1-dimethyl-3-nitro-2-pyrrolamine IUPAC Name: 3-azabicyclo[2.2.1]hepta-1,3,5-triene; N-chloro-N,1-dimethyl-3-nitropyrrol-2-amine Traditional Name: 3-azabicyclo[2.2.1]hepta-1,3,5-triene; chloro-methyl-(1-methyl-3-nitro-pyrrol-2-yl)amine Formula: C12H13ClN4O2 MolecularWeight: 280.71022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=C1N(C)Cl)[N+](=O)[O-].C1C2=CN=C1C=C2

Isomeric SMILES

CN1C=CC(=C1N(C)Cl)[N+](=O)[O-].C1C2=CN=C1C=C2

InChI

InChI=1S/C6H8ClN3O2.C6H5N/c1-8-4-3-5(10(11)12)6(8)9(2)7;1-2-6-3-5(1)4-7-6/h3-4H,1-2H3;1-2,4H,3H2