N-(3,5-dimethylphenyl)-6-naphthalen-2-yloxy-5-nitro-pyrimidin-4-amine

Systemtic Name: N-(3,5-dimethylphenyl)-6-naphthalen-2-yloxy-5-nitro-pyrimidin-4-amine Openeye Name: N-(3,5-dimethylphenyl)-6-(2-naphthyloxy)-5-nitro-pyrimidin-4-amine CAS Name: N-(3,5-dimethylphenyl)-6-(2-naphthalenyloxy)-5-nitro-4-pyrimidinamine IUPAC Name: N-(3,5-dimethylphenyl)-6-naphthalen-2-yloxy-5-nitropyrimidin-4-amine Traditional Name: (3,5-dimethylphenyl)-[6-(2-naphthoxy)-5-nitro-pyrimidin-4-yl]amine Formula: C22H18N4O3 MolecularWeight: 386.40332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC2=C(C(=NC=N2)OC3=CC4=CC=CC=C4C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1)NC2=C(C(=NC=N2)OC3=CC4=CC=CC=C4C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C22H18N4O3/c1-14-9-15(2)11-18(10-14)25-21-20(26(27)28)22(24-13-23-21)29-19-8-7-16-5-3-4-6-17(16)12-19/h3-13H,1-2H3,(H,23,24,25)