2-[2,4-bis(azanyl)-6-ethyl-pyrimidin-5-yl]-5-nitro-phenol

Systemtic Name: 2-[2,4-bis(azanyl)-6-ethyl-pyrimidin-5-yl]-5-nitro-phenol Openeye Name: 2-(2,4-diamino-6-ethyl-pyrimidin-5-yl)-5-nitro-phenol CAS Name: 2-(2,4-diamino-6-ethyl-5-pyrimidinyl)-5-nitrophenol IUPAC Name: 2-(2,4-diamino-6-ethylpyrimidin-5-yl)-5-nitrophenol Traditional Name: 2-(2,4-diamino-6-ethyl-pyrimidin-5-yl)-5-nitro-phenol Formula: C12H13N5O3 MolecularWeight: 275.26332

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)N)N)C2=C(C=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

CCC1=C(C(=NC(=N1)N)N)C2=C(C=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C12H13N5O3/c1-2-8-10(11(13)16-12(14)15-8)7-4-3-6(17(19)20)5-9(7)18/h3-5,18H,2H2,1H3,(H4,13,14,15,16)