N-[2-[2-(6-azanyl-5-nitro-pyrimidin-4-yl)hydrazinyl]-2-oxidanylidene-ethyl]-2-methyl-3-nitro-benzamide

Systemtic Name: N-[2-[2-(6-azanyl-5-nitro-pyrimidin-4-yl)hydrazinyl]-2-oxidanylidene-ethyl]-2-methyl-3-nitro-benzamide Openeye Name: N-[2-[2-(6-amino-5-nitro-pyrimidin-4-yl)hydrazino]-2-oxo-ethyl]-2-methyl-3-nitro-benzamide CAS Name: N-[2-[(6-amino-5-nitro-4-pyrimidinyl)hydrazo]-2-oxoethyl]-2-methyl-3-nitrobenzamide IUPAC Name: N-[2-[2-(6-amino-5-nitropyrimidin-4-yl)hydrazinyl]-2-oxoethyl]-2-methyl-3-nitrobenzamide Traditional Name: N-[2-[N'-(6-amino-5-nitro-pyrimidin-4-yl)hydrazino]-2-keto-ethyl]-2-methyl-3-nitro-benzamide Formula: C14H14N8O6 MolecularWeight: 390.31096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NCC(=O)NNC2=NC=NC(=C2[N+](=O)[O-])N

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NCC(=O)NNC2=NC=NC(=C2[N+](=O)[O-])N

InChI

InChI=1S/C14H14N8O6/c1-7-8(3-2-4-9(7)21(25)26)14(24)16-5-10(23)19-20-13-11(22(27)28)12(15)17-6-18-13/h2-4,6H,5H2,1H3,(H,16,24)(H,19,23)(H3,15,17,18,20)