N,N'-bis[(E)-1-(4-methyl-3-nitro-phenyl)ethylideneamino]propanediamide

Systemtic Name: N,N'-bis[(E)-1-(4-methyl-3-nitro-phenyl)ethylideneamino]propanediamide Openeye Name: N,N'-bis[(E)-1-(4-methyl-3-nitro-phenyl)ethylideneamino]propanediamide CAS Name: N,N'-bis[(E)-1-(4-methyl-3-nitrophenyl)ethylideneamino]propanediamide IUPAC Name: N,N'-bis[(E)-1-(4-methyl-3-nitrophenyl)ethylideneamino]propanediamide Traditional Name: N,N'-bis[(E)-1-(4-methyl-3-nitro-phenyl)ethylideneamino]malonamide Formula: C21H22N6O6 MolecularWeight: 454.43598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=NNC(=O)CC(=O)NN=C(C)C2=CC(=C(C=C2)C)[N+](=O)[O-])C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)/C(=N/NC(=O)CC(=O)N/N=C(/C2=CC(=C(C=C2)C)[N+](=O)[O-])\C)/C)[N+](=O)[O-]

InChI

InChI=1S/C21H22N6O6/c1-12-5-7-16(9-18(12)26(30)31)14(3)22-24-20(28)11-21(29)25-23-15(4)17-8-6-13(2)19(10-17)27(32)33/h5-10H,11H2,1-4H3,(H,24,28)(H,25,29)/b22-14+,23-15+