6-[(R)-(4-methoxyphenyl)-(pyrimidin-2-ylamino)methyl]-1,3-benzodioxol-5-ol

Systemtic Name: 6-[(R)-(4-methoxyphenyl)-(pyrimidin-2-ylamino)methyl]-1,3-benzodioxol-5-ol Openeye Name: 6-[(R)-(4-methoxyphenyl)-(pyrimidin-2-ylamino)methyl]-1,3-benzodioxol-5-ol CAS Name: 6-[(R)-(4-methoxyphenyl)-(2-pyrimidinylamino)methyl]-1,3-benzodioxol-5-ol IUPAC Name: 6-[(R)-(4-methoxyphenyl)-(pyrimidin-2-ylamino)methyl]-1,3-benzodioxol-5-ol Traditional Name: 6-[(R)-(4-methoxyphenyl)-(2-pyrimidylamino)methyl]sesamol Formula: C19H17N3O4 MolecularWeight: 351.35598

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC3=C(C=C2O)OCO3)NC4=NC=CC=N4

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](C2=CC3=C(C=C2O)OCO3)NC4=NC=CC=N4

InChI

InChI=1S/C19H17N3O4/c1-24-13-5-3-12(4-6-13)18(22-19-20-7-2-8-21-19)14-9-16-17(10-15(14)23)26-11-25-16/h2-10,18,23H,11H2,1H3,(H,20,21,22)/t18-/m1/s1