N-(3-methoxyphenyl)-5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-amine

Systemtic Name: N-(3-methoxyphenyl)-5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-amine Openeye Name: 6-(4-isopropylphenoxy)-N-(3-methoxyphenyl)-5-nitro-pyrimidin-4-amine CAS Name: N-(3-methoxyphenyl)-5-nitro-6-(4-propan-2-ylphenoxy)-4-pyrimidinamine IUPAC Name: N-(3-methoxyphenyl)-5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-amine Traditional Name: [6-(4-isopropylphenoxy)-5-nitro-pyrimidin-4-yl]-(3-methoxyphenyl)amine Formula: C20H20N4O4 MolecularWeight: 380.3972

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])NC3=CC(=CC=C3)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])NC3=CC(=CC=C3)OC

InChI

InChI=1S/C20H20N4O4/c1-13(2)14-7-9-16(10-8-14)28-20-18(24(25)26)19(21-12-22-20)23-15-5-4-6-17(11-15)27-3/h4-13H,1-3H3,(H,21,22,23)