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

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5-nitro-6-[2-(4-nitrophenyl)hydrazinyl]pyrimidin-4-amine Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5-nitro-6-[2-(4-nitrophenyl)hydrazino]pyrimidin-4-amine CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5-nitro-6-[(4-nitrophenyl)hydrazo]-4-pyrimidinamine IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5-nitro-6-[2-(4-nitrophenyl)hydrazinyl]pyrimidin-4-amine Traditional Name: homoveratryl-[5-nitro-6-[N'-(4-nitrophenyl)hydrazino]pyrimidin-4-yl]amine Formula: C20H21N7O6 MolecularWeight: 455.42404

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC2=C(C(=NC=N2)NNC3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC2=C(C(=NC=N2)NNC3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])OC

InChI

InChI=1S/C20H21N7O6/c1-32-16-8-3-13(11-17(16)33-2)9-10-21-19-18(27(30)31)20(23-12-22-19)25-24-14-4-6-15(7-5-14)26(28)29/h3-8,11-12,24H,9-10H2,1-2H3,(H2,21,22,23,25)