methyl (E)-3-(2-azanyl-4-nitro-phenyl)-2-cyano-prop-2-enoate

Systemtic Name: methyl (E)-3-(2-azanyl-4-nitro-phenyl)-2-cyano-prop-2-enoate Openeye Name: methyl (E)-3-(2-amino-4-nitro-phenyl)-2-cyano-prop-2-enoate CAS Name: (E)-3-(2-amino-4-nitrophenyl)-2-cyano-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-(2-amino-4-nitrophenyl)-2-cyanoprop-2-enoate Traditional Name: (E)-3-(2-amino-4-nitro-phenyl)-2-cyano-acrylic acid methyl ester Formula: C11H9N3O4 MolecularWeight: 247.20686

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CC1=C(C=C(C=C1)[N+](=O)[O-])N)C#N

Isomeric SMILES

COC(=O)/C(=C/C1=C(C=C(C=C1)[N+](=O)[O-])N)/C#N

InChI

InChI=1S/C11H9N3O4/c1-18-11(15)8(6-12)4-7-2-3-9(14(16)17)5-10(7)13/h2-5H,13H2,1H3/b8-4+