methyl 2-[2-(4,5-dimethoxy-2-nitro-phenyl)ethylamino]-5-nitro-benzoate

Systemtic Name: methyl 2-[2-(4,5-dimethoxy-2-nitro-phenyl)ethylamino]-5-nitro-benzoate Openeye Name: methyl 2-[2-(4,5-dimethoxy-2-nitro-phenyl)ethylamino]-5-nitro-benzoate CAS Name: 2-[2-(4,5-dimethoxy-2-nitrophenyl)ethylamino]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 2-[2-(4,5-dimethoxy-2-nitrophenyl)ethylamino]-5-nitrobenzoate Traditional Name: 2-[2-(4,5-dimethoxy-2-nitro-phenyl)ethylamino]-5-nitro-benzoic acid methyl ester Formula: C18H19N3O8 MolecularWeight: 405.35876

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OC)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OC)[N+](=O)[O-])OC

InChI

InChI=1S/C18H19N3O8/c1-27-16-8-11(15(21(25)26)10-17(16)28-2)6-7-19-14-5-4-12(20(23)24)9-13(14)18(22)29-3/h4-5,8-10,19H,6-7H2,1-3H3