N'-[6-(1-methoxypropan-2-ylamino)-5-nitro-pyrimidin-4-yl]-2-(4-nitrophenyl)ethanehydrazide

Systemtic Name: N'-[6-(1-methoxypropan-2-ylamino)-5-nitro-pyrimidin-4-yl]-2-(4-nitrophenyl)ethanehydrazide Openeye Name: N'-[6-[(2-methoxy-1-methyl-ethyl)amino]-5-nitro-pyrimidin-4-yl]-2-(4-nitrophenyl)acetohydrazide CAS Name: N'-[6-(1-methoxypropan-2-ylamino)-5-nitro-4-pyrimidinyl]-2-(4-nitrophenyl)acetohydrazide IUPAC Name: N'-[6-(1-methoxypropan-2-ylamino)-5-nitropyrimidin-4-yl]-2-(4-nitrophenyl)acetohydrazide Traditional Name: N'-[6-[(2-methoxy-1-methyl-ethyl)amino]-5-nitro-pyrimidin-4-yl]-2-(4-nitrophenyl)acetohydrazide Formula: C16H19N7O6 MolecularWeight: 405.36536

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)NC1=C(C(=NC=N1)NNC(=O)CC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(COC)NC1=C(C(=NC=N1)NNC(=O)CC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H19N7O6/c1-10(8-29-2)19-15-14(23(27)28)16(18-9-17-15)21-20-13(24)7-11-3-5-12(6-4-11)22(25)26/h3-6,9-10H,7-8H2,1-2H3,(H,20,24)(H2,17,18,19,21)