6-diazanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-diazanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-5-nitro-pyrimidin-4-amine Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydrazino-5-nitro-pyrimidin-4-amine CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydrazinyl-5-nitro-4-pyrimidinamine IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydrazinyl-5-nitropyrimidin-4-amine Traditional Name: homoveratryl-(6-hydrazino-5-nitro-pyrimidin-4-yl)amine Formula: C14H18N6O4 MolecularWeight: 334.33052

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC2=C(C(=NC=N2)NN)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC2=C(C(=NC=N2)NN)[N+](=O)[O-])OC

InChI

InChI=1S/C14H18N6O4/c1-23-10-4-3-9(7-11(10)24-2)5-6-16-13-12(20(21)22)14(19-15)18-8-17-13/h3-4,7-8H,5-6,15H2,1-2H3,(H2,16,17,18,19)