[2-ethoxy-4-[(E)-2-nitroethenyl]phenyl] 3,5-dinitrobenzoate

Systemtic Name: [2-ethoxy-4-[(E)-2-nitroethenyl]phenyl] 3,5-dinitrobenzoate Openeye Name: [2-ethoxy-4-[(E)-2-nitrovinyl]phenyl] 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid [2-ethoxy-4-[(E)-2-nitroethenyl]phenyl] ester IUPAC Name: [2-ethoxy-4-[(E)-2-nitroethenyl]phenyl] 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid [2-ethoxy-4-[(E)-2-nitrovinyl]phenyl] ester Formula: C17H13N3O9 MolecularWeight: 403.29982

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C[N+](=O)[O-])OC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C/[N+](=O)[O-])OC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H13N3O9/c1-2-28-16-7-11(5-6-18(22)23)3-4-15(16)29-17(21)12-8-13(19(24)25)10-14(9-12)20(26)27/h3-10H,2H2,1H3/b6-5+