1-[5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-yl]benzotriazole

Systemtic Name: 1-[5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-yl]benzotriazole Openeye Name: 1-[6-(4-isopropylphenoxy)-5-nitro-pyrimidin-4-yl]benzotriazole CAS Name: 1-[5-nitro-6-(4-propan-2-ylphenoxy)-4-pyrimidinyl]benzotriazole IUPAC Name: 1-[5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-yl]benzotriazole Traditional Name: 1-[6-(4-isopropylphenoxy)-5-nitro-pyrimidin-4-yl]benzotriazole Formula: C19H16N6O3 MolecularWeight: 376.36874

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])N3C4=CC=CC=C4N=N3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C19H16N6O3/c1-12(2)13-7-9-14(10-8-13)28-19-17(25(26)27)18(20-11-21-19)24-16-6-4-3-5-15(16)22-23-24/h3-12H,1-2H3