6-(octylamino)-1H-pyrimidin-2-one; (3S,4R,5R)-oxane-2,3,4,5-tetrol

Systemtic Name: 6-(octylamino)-1H-pyrimidin-2-one; (3S,4R,5R)-oxane-2,3,4,5-tetrol Openeye Name: 6-(octylamino)-1H-pyrimidin-2-one; (3S,4R,5R)-tetrahydropyran-2,3,4,5-tetrol CAS Name: 6-(octylamino)-1H-pyrimidin-2-one; (3S,4R,5R)-oxane-2,3,4,5-tetrol IUPAC Name: 6-(octylamino)-1H-pyrimidin-2-one; (3S,4R,5R)-oxane-2,3,4,5-tetrol Traditional Name: 6-(octylamino)-1H-pyrimidin-2-one; (3S,4R,5R)-tetrahydropyran-2,3,4,5-tetrol Formula: C17H31N3O6 MolecularWeight: 373.44454

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC1=CC=NC(=O)N1.C1C(C(C(C(O1)O)O)O)O

Isomeric SMILES

CCCCCCCCNC1=CC=NC(=O)N1.C1[C@H]([C@H]([C@@H](C(O1)O)O)O)O

InChI

InChI=1S/C12H21N3O.C5H10O5/c1-2-3-4-5-6-7-9-13-11-8-10-14-12(16)15-11;6-2-1-10-5(9)4(8)3(2)7/h8,10H,2-7,9H2,1H3,(H2,13,14,15,16);2-9H,1H2/t;2-,3-,4+,5?/m.1/s1