methyl 4-[(E)-2-(4-methoxyphenyl)ethenyl]-3,5-dinitro-benzoate

Systemtic Name: methyl 4-[(E)-2-(4-methoxyphenyl)ethenyl]-3,5-dinitro-benzoate Openeye Name: methyl 4-[(E)-2-(4-methoxyphenyl)vinyl]-3,5-dinitro-benzoate CAS Name: 4-[(E)-2-(4-methoxyphenyl)ethenyl]-3,5-dinitrobenzoic acid methyl ester IUPAC Name: methyl 4-[(E)-2-(4-methoxyphenyl)ethenyl]-3,5-dinitrobenzoate Traditional Name: 4-[(E)-2-(4-methoxyphenyl)vinyl]-3,5-dinitro-benzoic acid methyl ester Formula: C17H14N2O7 MolecularWeight: 358.30226

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC2=C(C=C(C=C2[N+](=O)[O-])C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C2=C(C=C(C=C2[N+](=O)[O-])C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C17H14N2O7/c1-25-13-6-3-11(4-7-13)5-8-14-15(18(21)22)9-12(17(20)26-2)10-16(14)19(23)24/h3-10H,1-2H3/b8-5+