[3-acetyloxy-5-[(E)-N-[(2,4-dinitrophenyl)amino]-C-methyl-carbonimidoyl]phenyl] ethanoate

Systemtic Name: [3-acetyloxy-5-[(E)-N-[(2,4-dinitrophenyl)amino]-C-methyl-carbonimidoyl]phenyl] ethanoate Openeye Name: [3-acetoxy-5-[(E)-N-(2,4-dinitroanilino)-C-methyl-carbonimidoyl]phenyl] acetate CAS Name: acetic acid [3-acetyloxy-5-[(1E)-1-[(2,4-dinitrophenyl)hydrazinylidene]ethyl]phenyl] ester IUPAC Name: [3-acetyloxy-5-[(E)-N-(2,4-dinitroanilino)-C-methylcarbonimidoyl]phenyl] acetate Traditional Name: acetic acid [3-acetoxy-5-[(E)-N-(2,4-dinitroanilino)-C-methyl-carbonimidoyl]phenyl] ester Formula: C18H16N4O8 MolecularWeight: 416.34164

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])C2=CC(=CC(=C2)OC(=O)C)OC(=O)C

Isomeric SMILES

C/C(=N\NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])/C2=CC(=CC(=C2)OC(=O)C)OC(=O)C

InChI

InChI=1S/C18H16N4O8/c1-10(13-6-15(29-11(2)23)9-16(7-13)30-12(3)24)19-20-17-5-4-14(21(25)26)8-18(17)22(27)28/h4-9,20H,1-3H3/b19-10+