N'-[6-(4-chloranyl-3-methyl-phenoxy)-5-nitro-pyrimidin-4-yl]naphthalene-1-carbohydrazide

Systemtic Name: N'-[6-(4-chloranyl-3-methyl-phenoxy)-5-nitro-pyrimidin-4-yl]naphthalene-1-carbohydrazide Openeye Name: N'-[6-(4-chloro-3-methyl-phenoxy)-5-nitro-pyrimidin-4-yl]naphthalene-1-carbohydrazide CAS Name: N'-[6-(4-chloro-3-methylphenoxy)-5-nitro-4-pyrimidinyl]-1-naphthalenecarbohydrazide IUPAC Name: N'-[6-(4-chloro-3-methylphenoxy)-5-nitropyrimidin-4-yl]naphthalene-1-carbohydrazide Traditional Name: N'-[6-(4-chloro-3-methyl-phenoxy)-5-nitro-pyrimidin-4-yl]naphthalene-1-carbohydrazide Formula: C22H16ClN5O4 MolecularWeight: 449.84654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=NC=NC(=C2[N+](=O)[O-])NNC(=O)C3=CC=CC4=CC=CC=C43)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=NC=NC(=C2[N+](=O)[O-])NNC(=O)C3=CC=CC4=CC=CC=C43)Cl

InChI

InChI=1S/C22H16ClN5O4/c1-13-11-15(9-10-18(13)23)32-22-19(28(30)31)20(24-12-25-22)26-27-21(29)17-8-4-6-14-5-2-3-7-16(14)17/h2-12H,1H3,(H,27,29)(H,24,25,26)