3-(2,4-dinitrobutyl)-2-methyl-5-nitro-1H-indole

Systemtic Name: 3-(2,4-dinitrobutyl)-2-methyl-5-nitro-1H-indole Openeye Name: 3-(2,4-dinitrobutyl)-2-methyl-5-nitro-1H-indole CAS Name: 3-(2,4-dinitrobutyl)-2-methyl-5-nitro-1H-indole IUPAC Name: 3-(2,4-dinitrobutyl)-2-methyl-5-nitro-1H-indole Traditional Name: 3-(2,4-dinitrobutyl)-2-methyl-5-nitro-1H-indole Formula: C13H14N4O6 MolecularWeight: 322.27346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1)C=CC(=C2)[N+](=O)[O-])CC(CC[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C2=C(N1)C=CC(=C2)[N+](=O)[O-])CC(CC[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H14N4O6/c1-8-11(6-10(17(22)23)4-5-15(18)19)12-7-9(16(20)21)2-3-13(12)14-8/h2-3,7,10,14H,4-6H2,1H3