4-(1,3-benzodioxol-5-ylmethylamino)-2-(2-hydroxyethyloxy)quinazoline-6-carbonitrile

Systemtic Name: 4-(1,3-benzodioxol-5-ylmethylamino)-2-(2-hydroxyethyloxy)quinazoline-6-carbonitrile Openeye Name: 4-(1,3-benzodioxol-5-ylmethylamino)-2-(2-hydroxyethoxy)quinazoline-6-carbonitrile CAS Name: 4-(1,3-benzodioxol-5-ylmethylamino)-2-(2-hydroxyethoxy)-6-quinazolinecarbonitrile IUPAC Name: 4-(1,3-benzodioxol-5-ylmethylamino)-2-(2-hydroxyethoxy)quinazoline-6-carbonitrile Traditional Name: 2-(2-hydroxyethoxy)-4-(piperonylamino)quinazoline-6-carbonitrile Formula: C19H16N4O4 MolecularWeight: 364.35474

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=NC(=NC4=C3C=C(C=C4)C#N)OCCO

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=NC(=NC4=C3C=C(C=C4)C#N)OCCO

InChI

InChI=1S/C19H16N4O4/c20-9-12-1-3-15-14(7-12)18(23-19(22-15)25-6-5-24)21-10-13-2-4-16-17(8-13)27-11-26-16/h1-4,7-8,24H,5-6,10-11H2,(H,21,22,23)