5-nitro-N4-[(E)-(3,4,5-trimethoxyphenyl)methylideneamino]pyrimidine-4,6-diamine

Systemtic Name: 5-nitro-N4-[(E)-(3,4,5-trimethoxyphenyl)methylideneamino]pyrimidine-4,6-diamine Openeye Name: 5-nitro-N4-[(E)-(3,4,5-trimethoxyphenyl)methyleneamino]pyrimidine-4,6-diamine CAS Name: 5-nitro-N4-[(E)-(3,4,5-trimethoxyphenyl)methylideneamino]pyrimidine-4,6-diamine IUPAC Name: 5-nitro-4-N-[(E)-(3,4,5-trimethoxyphenyl)methylideneamino]pyrimidine-4,6-diamine Traditional Name: (6-amino-5-nitro-pyrimidin-4-yl)-[(E)-(3,4,5-trimethoxybenzylidene)amino]amine Formula: C14H16N6O5 MolecularWeight: 348.31404

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C=NNC2=NC=NC(=C2[N+](=O)[O-])N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)/C=N/NC2=NC=NC(=C2[N+](=O)[O-])N

InChI

InChI=1S/C14H16N6O5/c1-23-9-4-8(5-10(24-2)12(9)25-3)6-18-19-14-11(20(21)22)13(15)16-7-17-14/h4-7H,1-3H3,(H3,15,16,17,19)/b18-6+