N-[(E)-3-(3-methyloxiran-2-yl)propylideneamino]-2,4-dinitro-aniline

Systemtic Name: N-[(E)-3-(3-methyloxiran-2-yl)propylideneamino]-2,4-dinitro-aniline Openeye Name: N-[(E)-3-(3-methyloxiran-2-yl)propylideneamino]-2,4-dinitro-aniline CAS Name: N-[(E)-3-(3-methyl-2-oxiranyl)propylideneamino]-2,4-dinitroaniline IUPAC Name: N-[(E)-3-(3-methyloxiran-2-yl)propylideneamino]-2,4-dinitroaniline Traditional Name: (2,4-dinitrophenyl)-[(E)-3-(3-methyloxiran-2-yl)propylideneamino]amine Formula: C12H14N4O5 MolecularWeight: 294.26336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(O1)CCC=NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1C(O1)CC/C=N/NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H14N4O5/c1-8-12(21-8)3-2-6-13-14-10-5-4-9(15(17)18)7-11(10)16(19)20/h4-8,12,14H,2-3H2,1H3/b13-6+