6-(4-chloranyl-3,5-dimethyl-phenoxy)-N-naphthalen-1-yl-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-(4-chloranyl-3,5-dimethyl-phenoxy)-N-naphthalen-1-yl-5-nitro-pyrimidin-4-amine Openeye Name: 6-(4-chloro-3,5-dimethyl-phenoxy)-N-(1-naphthyl)-5-nitro-pyrimidin-4-amine CAS Name: 6-(4-chloro-3,5-dimethylphenoxy)-N-(1-naphthalenyl)-5-nitro-4-pyrimidinamine IUPAC Name: 6-(4-chloro-3,5-dimethylphenoxy)-N-naphthalen-1-yl-5-nitropyrimidin-4-amine Traditional Name: [6-(4-chloro-3,5-dimethyl-phenoxy)-5-nitro-pyrimidin-4-yl]-(1-naphthyl)amine Formula: C22H17ClN4O3 MolecularWeight: 420.84838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H17ClN4O3/c1-13-10-16(11-14(2)19(13)23)30-22-20(27(28)29)21(24-12-25-22)26-18-9-5-7-15-6-3-4-8-17(15)18/h3-12H,1-2H3,(H,24,25,26)