N'-[6-(4-chloranyl-3,5-dimethyl-phenoxy)-5-nitro-pyrimidin-4-yl]furan-2-carbohydrazide

Systemtic Name: N'-[6-(4-chloranyl-3,5-dimethyl-phenoxy)-5-nitro-pyrimidin-4-yl]furan-2-carbohydrazide Openeye Name: N'-[6-(4-chloro-3,5-dimethyl-phenoxy)-5-nitro-pyrimidin-4-yl]furan-2-carbohydrazide CAS Name: N'-[6-(4-chloro-3,5-dimethylphenoxy)-5-nitro-4-pyrimidinyl]-2-furancarbohydrazide IUPAC Name: N'-[6-(4-chloro-3,5-dimethylphenoxy)-5-nitropyrimidin-4-yl]furan-2-carbohydrazide Traditional Name: N'-[6-(4-chloro-3,5-dimethyl-phenoxy)-5-nitro-pyrimidin-4-yl]-2-furohydrazide Formula: C17H14ClN5O5 MolecularWeight: 403.77656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OC2=NC=NC(=C2[N+](=O)[O-])NNC(=O)C3=CC=CO3

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OC2=NC=NC(=C2[N+](=O)[O-])NNC(=O)C3=CC=CO3

InChI

InChI=1S/C17H14ClN5O5/c1-9-6-11(7-10(2)13(9)18)28-17-14(23(25)26)15(19-8-20-17)21-22-16(24)12-4-3-5-27-12/h3-8H,1-2H3,(H,22,24)(H,19,20,21)