N'-[5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-yl]-2-phenyl-ethanehydrazide

Systemtic Name: N'-[5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-yl]-2-phenyl-ethanehydrazide Openeye Name: N'-[6-(4-isopropylphenoxy)-5-nitro-pyrimidin-4-yl]-2-phenyl-acetohydrazide CAS Name: N'-[5-nitro-6-(4-propan-2-ylphenoxy)-4-pyrimidinyl]-2-phenylacetohydrazide IUPAC Name: N'-[5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-yl]-2-phenylacetohydrazide Traditional Name: N'-[6-(4-isopropylphenoxy)-5-nitro-pyrimidin-4-yl]-2-phenyl-acetohydrazide Formula: C21H21N5O4 MolecularWeight: 407.42254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])NNC(=O)CC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])NNC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H21N5O4/c1-14(2)16-8-10-17(11-9-16)30-21-19(26(28)29)20(22-13-23-21)25-24-18(27)12-15-6-4-3-5-7-15/h3-11,13-14H,12H2,1-2H3,(H,24,27)(H,22,23,25)