N'-[6-[(3-chlorophenyl)amino]-5-nitro-pyrimidin-4-yl]-2-phenoxy-ethanehydrazide

Systemtic Name: N'-[6-[(3-chlorophenyl)amino]-5-nitro-pyrimidin-4-yl]-2-phenoxy-ethanehydrazide Openeye Name: N'-[6-(3-chloroanilino)-5-nitro-pyrimidin-4-yl]-2-phenoxy-acetohydrazide CAS Name: N'-[6-(3-chloroanilino)-5-nitro-4-pyrimidinyl]-2-phenoxyacetohydrazide IUPAC Name: N'-[6-(3-chloroanilino)-5-nitropyrimidin-4-yl]-2-phenoxyacetohydrazide Traditional Name: N'-[6-(3-chloroanilino)-5-nitro-pyrimidin-4-yl]-2-phenoxy-acetohydrazide Formula: C18H15ClN6O4 MolecularWeight: 414.8025

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC(=O)NNC2=NC=NC(=C2[N+](=O)[O-])NC3=CC(=CC=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)OCC(=O)NNC2=NC=NC(=C2[N+](=O)[O-])NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H15ClN6O4/c19-12-5-4-6-13(9-12)22-17-16(25(27)28)18(21-11-20-17)24-23-15(26)10-29-14-7-2-1-3-8-14/h1-9,11H,10H2,(H,23,26)(H2,20,21,22,24)