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

Systemtic Name: N'-[6-(4-chloranyl-3-methyl-phenoxy)-5-nitro-pyrimidin-4-yl]-4-nitro-benzohydrazide Openeye Name: N'-[6-(4-chloro-3-methyl-phenoxy)-5-nitro-pyrimidin-4-yl]-4-nitro-benzohydrazide CAS Name: N'-[6-(4-chloro-3-methylphenoxy)-5-nitro-4-pyrimidinyl]-4-nitrobenzohydrazide IUPAC Name: N'-[6-(4-chloro-3-methylphenoxy)-5-nitropyrimidin-4-yl]-4-nitrobenzohydrazide Traditional Name: N'-[6-(4-chloro-3-methyl-phenoxy)-5-nitro-pyrimidin-4-yl]-4-nitro-benzohydrazide Formula: C18H13ClN6O6 MolecularWeight: 444.78542

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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=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

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

InChI

InChI=1S/C18H13ClN6O6/c1-10-8-13(6-7-14(10)19)31-18-15(25(29)30)16(20-9-21-18)22-23-17(26)11-2-4-12(5-3-11)24(27)28/h2-9H,1H3,(H,23,26)(H,20,21,22)