N-(5-chloranyl-2,4-dimethoxy-phenyl)-6-naphthalen-2-yloxy-5-nitro-pyrimidin-4-amine

Systemtic Name: N-(5-chloranyl-2,4-dimethoxy-phenyl)-6-naphthalen-2-yloxy-5-nitro-pyrimidin-4-amine Openeye Name: N-(5-chloro-2,4-dimethoxy-phenyl)-6-(2-naphthyloxy)-5-nitro-pyrimidin-4-amine CAS Name: N-(5-chloro-2,4-dimethoxyphenyl)-6-(2-naphthalenyloxy)-5-nitro-4-pyrimidinamine IUPAC Name: N-(5-chloro-2,4-dimethoxyphenyl)-6-naphthalen-2-yloxy-5-nitropyrimidin-4-amine Traditional Name: (5-chloro-2,4-dimethoxy-phenyl)-[6-(2-naphthoxy)-5-nitro-pyrimidin-4-yl]amine Formula: C22H17ClN4O5 MolecularWeight: 452.84718

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC2=C(C(=NC=N2)OC3=CC4=CC=CC=C4C=C3)[N+](=O)[O-])Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1NC2=C(C(=NC=N2)OC3=CC4=CC=CC=C4C=C3)[N+](=O)[O-])Cl)OC

InChI

InChI=1S/C22H17ClN4O5/c1-30-18-11-19(31-2)17(10-16(18)23)26-21-20(27(28)29)22(25-12-24-21)32-15-8-7-13-5-3-4-6-14(13)9-15/h3-12H,1-2H3,(H,24,25,26)