dimethyl 5-[[5-nitro-6-[2-(2-phenylethanoyl)hydrazinyl]pyrimidin-4-yl]amino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[[5-nitro-6-[2-(2-phenylethanoyl)hydrazinyl]pyrimidin-4-yl]amino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[5-nitro-6-[2-(2-phenylacetyl)hydrazino]pyrimidin-4-yl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[5-nitro-6-[(1-oxo-2-phenylethyl)hydrazo]-4-pyrimidinyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[5-nitro-6-[2-(2-phenylacetyl)hydrazinyl]pyrimidin-4-yl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[5-nitro-6-[N'-(2-phenylacetyl)hydrazino]pyrimidin-4-yl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C22H20N6O7 MolecularWeight: 480.4302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC2=C(C(=NC=N2)NNC(=O)CC3=CC=CC=C3)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC2=C(C(=NC=N2)NNC(=O)CC3=CC=CC=C3)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C22H20N6O7/c1-34-21(30)14-9-15(22(31)35-2)11-16(10-14)25-19-18(28(32)33)20(24-12-23-19)27-26-17(29)8-13-6-4-3-5-7-13/h3-7,9-12H,8H2,1-2H3,(H,26,29)(H2,23,24,25,27)