2-(1,3-benzodioxol-5-yloxymethyl)-5-(pyridin-3-ylmethylamino)-1,3-oxazole-4-carbonitrile

Systemtic Name: 2-(1,3-benzodioxol-5-yloxymethyl)-5-(pyridin-3-ylmethylamino)-1,3-oxazole-4-carbonitrile Openeye Name: 2-(1,3-benzodioxol-5-yloxymethyl)-5-(3-pyridylmethylamino)oxazole-4-carbonitrile CAS Name: 2-(1,3-benzodioxol-5-yloxymethyl)-5-(3-pyridinylmethylamino)-4-oxazolecarbonitrile IUPAC Name: 2-(1,3-benzodioxol-5-yloxymethyl)-5-(pyridin-3-ylmethylamino)-1,3-oxazole-4-carbonitrile Traditional Name: 2-(1,3-benzodioxol-5-yloxymethyl)-5-(3-pyridylmethylamino)oxazole-4-carbonitrile Formula: C18H14N4O4 MolecularWeight: 350.32816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)OCC3=NC(=C(O3)NCC4=CN=CC=C4)C#N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)OCC3=NC(=C(O3)NCC4=CN=CC=C4)C#N

InChI

InChI=1S/C18H14N4O4/c19-7-14-18(21-9-12-2-1-5-20-8-12)26-17(22-14)10-23-13-3-4-15-16(6-13)25-11-24-15/h1-6,8,21H,9-11H2