4,6-bis(3,5-dimethylphenoxy)-5-nitro-pyrimidine

Systemtic Name: 4,6-bis(3,5-dimethylphenoxy)-5-nitro-pyrimidine Openeye Name: 4,6-bis(3,5-dimethylphenoxy)-5-nitro-pyrimidine CAS Name: 4,6-bis(3,5-dimethylphenoxy)-5-nitropyrimidine IUPAC Name: 4,6-bis(3,5-dimethylphenoxy)-5-nitropyrimidine Traditional Name: 4,6-bis(3,5-dimethylphenoxy)-5-nitro-pyrimidine Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2=C(C(=NC=N2)OC3=CC(=CC(=C3)C)C)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1)OC2=C(C(=NC=N2)OC3=CC(=CC(=C3)C)C)[N+](=O)[O-])C

InChI

InChI=1S/C20H19N3O4/c1-12-5-13(2)8-16(7-12)26-19-18(23(24)25)20(22-11-21-19)27-17-9-14(3)6-15(4)10-17/h5-11H,1-4H3