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

Systemtic Name: N'-[6-(4-chloranyl-3-methyl-phenoxy)-5-nitro-pyrimidin-4-yl]pyridine-3-carbohydrazide Openeye Name: N'-[6-(4-chloro-3-methyl-phenoxy)-5-nitro-pyrimidin-4-yl]pyridine-3-carbohydrazide CAS Name: N'-[6-(4-chloro-3-methylphenoxy)-5-nitro-4-pyrimidinyl]-3-pyridinecarbohydrazide IUPAC Name: N'-[6-(4-chloro-3-methylphenoxy)-5-nitropyrimidin-4-yl]pyridine-3-carbohydrazide Traditional Name: N'-[6-(4-chloro-3-methyl-phenoxy)-5-nitro-pyrimidin-4-yl]nicotinohydrazide Formula: C17H13ClN6O4 MolecularWeight: 400.77592

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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=CN=CC=C3)Cl

Isomeric SMILES

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

InChI

InChI=1S/C17H13ClN6O4/c1-10-7-12(4-5-13(10)18)28-17-14(24(26)27)15(20-9-21-17)22-23-16(25)11-3-2-6-19-8-11/h2-9H,1H3,(H,23,25)(H,20,21,22)