methyl 2-[4-[3-methoxy-5-[(E)-2-nitroethenyl]-2-oxidanyl-phenoxy]-3,5-dinitro-phenyl]ethanoate

Systemtic Name: methyl 2-[4-[3-methoxy-5-[(E)-2-nitroethenyl]-2-oxidanyl-phenoxy]-3,5-dinitro-phenyl]ethanoate Openeye Name: methyl 2-[4-[2-hydroxy-3-methoxy-5-[(E)-2-nitrovinyl]phenoxy]-3,5-dinitro-phenyl]acetate CAS Name: 2-[4-[2-hydroxy-3-methoxy-5-[(E)-2-nitroethenyl]phenoxy]-3,5-dinitrophenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-[2-hydroxy-3-methoxy-5-[(E)-2-nitroethenyl]phenoxy]-3,5-dinitrophenyl]acetate Traditional Name: 2-[4-[2-hydroxy-3-methoxy-5-[(E)-2-nitrovinyl]phenoxy]-3,5-dinitro-phenyl]acetic acid methyl ester Formula: C18H15N3O11 MolecularWeight: 449.3252

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)OC2=C(C=C(C=C2[N+](=O)[O-])CC(=O)OC)[N+](=O)[O-])C=C[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1O)OC2=C(C=C(C=C2[N+](=O)[O-])CC(=O)OC)[N+](=O)[O-])/C=C/[N+](=O)[O-]

InChI

InChI=1S/C18H15N3O11/c1-30-14-7-10(3-4-19(24)25)8-15(17(14)23)32-18-12(20(26)27)5-11(9-16(22)31-2)6-13(18)21(28)29/h3-8,23H,9H2,1-2H3/b4-3+