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

Systemtic Name: N'-[6-(4-chloranyl-3-methyl-phenoxy)-5-nitro-pyrimidin-4-yl]furan-2-carbohydrazide Openeye Name: N'-[6-(4-chloro-3-methyl-phenoxy)-5-nitro-pyrimidin-4-yl]furan-2-carbohydrazide CAS Name: N'-[6-(4-chloro-3-methylphenoxy)-5-nitro-4-pyrimidinyl]-2-furancarbohydrazide IUPAC Name: N'-[6-(4-chloro-3-methylphenoxy)-5-nitropyrimidin-4-yl]furan-2-carbohydrazide Traditional Name: N'-[6-(4-chloro-3-methyl-phenoxy)-5-nitro-pyrimidin-4-yl]-2-furohydrazide Formula: C16H12ClN5O5 MolecularWeight: 389.74998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=NC=NC(=C2[N+](=O)[O-])NNC(=O)C3=CC=CO3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=NC=NC(=C2[N+](=O)[O-])NNC(=O)C3=CC=CO3)Cl

InChI

InChI=1S/C16H12ClN5O5/c1-9-7-10(4-5-11(9)17)27-16-13(22(24)25)14(18-8-19-16)20-21-15(23)12-3-2-6-26-12/h2-8H,1H3,(H,21,23)(H,18,19,20)