N-[2-(2,3-dimethoxyphenyl)ethyl]-6-morpholin-4-yl-5-nitro-pyrimidin-4-amine

Systemtic Name: N-[2-(2,3-dimethoxyphenyl)ethyl]-6-morpholin-4-yl-5-nitro-pyrimidin-4-amine Openeye Name: N-[2-(2,3-dimethoxyphenyl)ethyl]-6-morpholino-5-nitro-pyrimidin-4-amine CAS Name: N-[2-(2,3-dimethoxyphenyl)ethyl]-6-(4-morpholinyl)-5-nitro-4-pyrimidinamine IUPAC Name: N-[2-(2,3-dimethoxyphenyl)ethyl]-6-morpholin-4-yl-5-nitropyrimidin-4-amine Traditional Name: 2-(2,3-dimethoxyphenyl)ethyl-(6-morpholino-5-nitro-pyrimidin-4-yl)amine Formula: C18H23N5O5 MolecularWeight: 389.40572

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)CCNC2=NC=NC(=C2[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

COC1=CC=CC(=C1OC)CCNC2=NC=NC(=C2[N+](=O)[O-])N3CCOCC3

InChI

InChI=1S/C18H23N5O5/c1-26-14-5-3-4-13(16(14)27-2)6-7-19-17-15(23(24)25)18(21-12-20-17)22-8-10-28-11-9-22/h3-5,12H,6-11H2,1-2H3,(H,19,20,21)