N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-6-(2,6-dimethylmorpholin-4-yl)-5-nitro-pyrimidin-4-amine

Systemtic Name: N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-6-(2,6-dimethylmorpholin-4-yl)-5-nitro-pyrimidin-4-amine Openeye Name: N-(2,3-dihydrobenzofuran-5-ylmethyl)-6-(2,6-dimethylmorpholin-4-yl)-5-nitro-pyrimidin-4-amine CAS Name: N-(2,3-dihydrobenzofuran-5-ylmethyl)-6-(2,6-dimethyl-4-morpholinyl)-5-nitro-4-pyrimidinamine IUPAC Name: N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-6-(2,6-dimethylmorpholin-4-yl)-5-nitropyrimidin-4-amine Traditional Name: coumaran-5-ylmethyl-[6-(2,6-dimethylmorpholino)-5-nitro-pyrimidin-4-yl]amine Formula: C19H23N5O4 MolecularWeight: 385.41702

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C2=C(C(=NC=N2)NCC3=CC4=C(C=C3)OCC4)[N+](=O)[O-]

Isomeric SMILES

CC1CN(CC(O1)C)C2=C(C(=NC=N2)NCC3=CC4=C(C=C3)OCC4)[N+](=O)[O-]

InChI

InChI=1S/C19H23N5O4/c1-12-9-23(10-13(2)28-12)19-17(24(25)26)18(21-11-22-19)20-8-14-3-4-16-15(7-14)5-6-27-16/h3-4,7,11-13H,5-6,8-10H2,1-2H3,(H,20,21,22)