5-nitro-4,6-bis(4-propan-2-ylphenoxy)pyrimidine

Systemtic Name: 5-nitro-4,6-bis(4-propan-2-ylphenoxy)pyrimidine Openeye Name: 4,6-bis(4-isopropylphenoxy)-5-nitro-pyrimidine CAS Name: 5-nitro-4,6-bis(4-propan-2-ylphenoxy)pyrimidine IUPAC Name: 5-nitro-4,6-bis(4-propan-2-ylphenoxy)pyrimidine Traditional Name: 4,6-bis(4-isopropylphenoxy)-5-nitro-pyrimidine Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O4/c1-14(2)16-5-9-18(10-6-16)28-21-20(25(26)27)22(24-13-23-21)29-19-11-7-17(8-12-19)15(3)4/h5-15H,1-4H3