2-[[2-(1,3-benzodioxol-5-ylmethylamino)pteridin-4-yl]amino]ethanol

Systemtic Name: 2-[[2-(1,3-benzodioxol-5-ylmethylamino)pteridin-4-yl]amino]ethanol Openeye Name: 2-[[2-(1,3-benzodioxol-5-ylmethylamino)pteridin-4-yl]amino]ethanol CAS Name: 2-[[2-(1,3-benzodioxol-5-ylmethylamino)-4-pteridinyl]amino]ethanol IUPAC Name: 2-[[2-(1,3-benzodioxol-5-ylmethylamino)pteridin-4-yl]amino]ethanol Traditional Name: 2-[[2-(piperonylamino)pteridin-4-yl]amino]ethanol Formula: C16H16N6O3 MolecularWeight: 340.33664

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=NC4=NC=CN=C4C(=N3)NCCO

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=NC4=NC=CN=C4C(=N3)NCCO

InChI

InChI=1S/C16H16N6O3/c23-6-5-19-15-13-14(18-4-3-17-13)21-16(22-15)20-8-10-1-2-11-12(7-10)25-9-24-11/h1-4,7,23H,5-6,8-9H2,(H2,18,19,20,21,22)