N-[(2-methoxypyridin-3-yl)methyl]-2,4-dinitro-aniline

Systemtic Name: N-[(2-methoxypyridin-3-yl)methyl]-2,4-dinitro-aniline Openeye Name: N-[(2-methoxy-3-pyridyl)methyl]-2,4-dinitro-aniline CAS Name: N-[(2-methoxy-3-pyridinyl)methyl]-2,4-dinitroaniline IUPAC Name: N-[(2-methoxypyridin-3-yl)methyl]-2,4-dinitroaniline Traditional Name: (2,4-dinitrophenyl)-[(2-methoxy-3-pyridyl)methyl]amine Formula: C13H12N4O5 MolecularWeight: 304.25818

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC=N1)CNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC=N1)CNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H12N4O5/c1-22-13-9(3-2-6-14-13)8-15-11-5-4-10(16(18)19)7-12(11)17(20)21/h2-7,15H,8H2,1H3