N-[3-(4,6-dimethylpyrimidin-2-yl)oxyphenyl]-4,5-dimethoxy-2-nitro-benzamide

Systemtic Name: N-[3-(4,6-dimethylpyrimidin-2-yl)oxyphenyl]-4,5-dimethoxy-2-nitro-benzamide Openeye Name: N-[3-(4,6-dimethylpyrimidin-2-yl)oxyphenyl]-4,5-dimethoxy-2-nitro-benzamide CAS Name: N-[3-[(4,6-dimethyl-2-pyrimidinyl)oxy]phenyl]-4,5-dimethoxy-2-nitrobenzamide IUPAC Name: N-[3-(4,6-dimethylpyrimidin-2-yl)oxyphenyl]-4,5-dimethoxy-2-nitrobenzamide Traditional Name: N-[3-(4,6-dimethylpyrimidin-2-yl)oxyphenyl]-4,5-dimethoxy-2-nitro-benzamide Formula: C21H20N4O6 MolecularWeight: 424.4067

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)OC2=CC=CC(=C2)NC(=O)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC)C

Isomeric SMILES

CC1=CC(=NC(=N1)OC2=CC=CC(=C2)NC(=O)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC)C

InChI

InChI=1S/C21H20N4O6/c1-12-8-13(2)23-21(22-12)31-15-7-5-6-14(9-15)24-20(26)16-10-18(29-3)19(30-4)11-17(16)25(27)28/h5-11H,1-4H3,(H,24,26)