2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-N4-(4-methoxyphenyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: 2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-N4-(4-methoxyphenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: 2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-N4-(4-methoxyphenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: 2-[(2R,6R)-2,6-dimethyl-4-morpholinyl]-N4-(4-methoxyphenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-4-N-(4-methoxyphenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: [6-amino-2-[(2R,6R)-2,6-dimethylmorpholino]-5-nitro-pyrimidin-4-yl]-(4-methoxyphenyl)amine Formula: C17H22N6O4 MolecularWeight: 374.39438

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C2=NC(=C(C(=N2)NC3=CC=C(C=C3)OC)[N+](=O)[O-])N

Isomeric SMILES

C[C@@H]1CN(C[C@H](O1)C)C2=NC(=C(C(=N2)NC3=CC=C(C=C3)OC)[N+](=O)[O-])N

InChI

InChI=1S/C17H22N6O4/c1-10-8-22(9-11(2)27-10)17-20-15(18)14(23(24)25)16(21-17)19-12-4-6-13(26-3)7-5-12/h4-7,10-11H,8-9H2,1-3H3,(H3,18,19,20,21)/t10-,11-/m1/s1