N-[(E)-(5-methoxy-2,3-dihydro-1-benzofuran-6-yl)methylideneamino]-2,4-dinitro-aniline

Systemtic Name: N-[(E)-(5-methoxy-2,3-dihydro-1-benzofuran-6-yl)methylideneamino]-2,4-dinitro-aniline Openeye Name: N-[(E)-(5-methoxy-2,3-dihydrobenzofuran-6-yl)methyleneamino]-2,4-dinitro-aniline CAS Name: N-[(E)-(5-methoxy-2,3-dihydrobenzofuran-6-yl)methylideneamino]-2,4-dinitroaniline IUPAC Name: N-[(E)-(5-methoxy-2,3-dihydro-1-benzofuran-6-yl)methylideneamino]-2,4-dinitroaniline Traditional Name: (2,4-dinitrophenyl)-[(E)-(5-methoxycoumaran-6-yl)methyleneamino]amine Formula: C16H14N4O6 MolecularWeight: 358.30556

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1C=NNC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])OCC2

Isomeric SMILES

COC1=CC2=C(C=C1/C=N/NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])OCC2

InChI

InChI=1S/C16H14N4O6/c1-25-15-6-10-4-5-26-16(10)7-11(15)9-17-18-13-3-2-12(19(21)22)8-14(13)20(23)24/h2-3,6-9,18H,4-5H2,1H3/b17-9+