N-[(E)-(4-methylpyridin-3-yl)methylideneamino]-2,4-dinitro-aniline

Systemtic Name: N-[(E)-(4-methylpyridin-3-yl)methylideneamino]-2,4-dinitro-aniline Openeye Name: N-[(E)-(4-methyl-3-pyridyl)methyleneamino]-2,4-dinitro-aniline CAS Name: N-[(E)-(4-methyl-3-pyridinyl)methylideneamino]-2,4-dinitroaniline IUPAC Name: N-[(E)-(4-methylpyridin-3-yl)methylideneamino]-2,4-dinitroaniline Traditional Name: (2,4-dinitrophenyl)-[(E)-(4-methyl-3-pyridyl)methyleneamino]amine Formula: C13H11N5O4 MolecularWeight: 301.25754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NC=C1)C=NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=NC=C1)/C=N/NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H11N5O4/c1-9-4-5-14-7-10(9)8-15-16-12-3-2-11(17(19)20)6-13(12)18(21)22/h2-8,16H,1H3/b15-8+