4-(4-methoxy-3-nitro-phenyl)-N-(3-phenoxyphenyl)pyrimidin-2-amine

Systemtic Name: 4-(4-methoxy-3-nitro-phenyl)-N-(3-phenoxyphenyl)pyrimidin-2-amine Openeye Name: 4-(4-methoxy-3-nitro-phenyl)-N-(3-phenoxyphenyl)pyrimidin-2-amine CAS Name: 4-(4-methoxy-3-nitrophenyl)-N-(3-phenoxyphenyl)-2-pyrimidinamine IUPAC Name: 4-(4-methoxy-3-nitrophenyl)-N-(3-phenoxyphenyl)pyrimidin-2-amine Traditional Name: [4-(4-methoxy-3-nitro-phenyl)pyrimidin-2-yl]-(3-phenoxyphenyl)amine Formula: C23H18N4O4 MolecularWeight: 414.41342

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=NC=C2)NC3=CC(=CC=C3)OC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=NC=C2)NC3=CC(=CC=C3)OC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H18N4O4/c1-30-22-11-10-16(14-21(22)27(28)29)20-12-13-24-23(26-20)25-17-6-5-9-19(15-17)31-18-7-3-2-4-8-18/h2-15H,1H3,(H,24,25,26)