methyl 3-[4-[(2,4-dinitrophenyl)diazenyl]phenyl]propanoate

Systemtic Name: methyl 3-[4-[(2,4-dinitrophenyl)diazenyl]phenyl]propanoate Openeye Name: methyl 3-[4-(2,4-dinitrophenyl)azophenyl]propanoate CAS Name: 3-[4-(2,4-dinitrophenyl)azophenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-[(2,4-dinitrophenyl)diazenyl]phenyl]propanoate Traditional Name: 3-[4-(2,4-dinitrophenyl)azophenyl]propionic acid methyl ester Formula: C16H14N4O6 MolecularWeight: 358.30556

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC(=O)CCC1=CC=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H14N4O6/c1-26-16(21)9-4-11-2-5-12(6-3-11)17-18-14-8-7-13(19(22)23)10-15(14)20(24)25/h2-3,5-8,10H,4,9H2,1H3