N-(5-chloranyl-2,4-dimethoxy-phenyl)-6-morpholin-4-yl-5-nitro-pyrimidin-4-amine

Systemtic Name: N-(5-chloranyl-2,4-dimethoxy-phenyl)-6-morpholin-4-yl-5-nitro-pyrimidin-4-amine Openeye Name: N-(5-chloro-2,4-dimethoxy-phenyl)-6-morpholino-5-nitro-pyrimidin-4-amine CAS Name: N-(5-chloro-2,4-dimethoxyphenyl)-6-(4-morpholinyl)-5-nitro-4-pyrimidinamine IUPAC Name: N-(5-chloro-2,4-dimethoxyphenyl)-6-morpholin-4-yl-5-nitropyrimidin-4-amine Traditional Name: (5-chloro-2,4-dimethoxy-phenyl)-(6-morpholino-5-nitro-pyrimidin-4-yl)amine Formula: C16H18ClN5O5 MolecularWeight: 395.79762

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC2=NC=NC(=C2[N+](=O)[O-])N3CCOCC3)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1NC2=NC=NC(=C2[N+](=O)[O-])N3CCOCC3)Cl)OC

InChI

InChI=1S/C16H18ClN5O5/c1-25-12-8-13(26-2)11(7-10(12)17)20-15-14(22(23)24)16(19-9-18-15)21-3-5-27-6-4-21/h7-9H,3-6H2,1-2H3,(H,18,19,20)