2-[4-(1,3-benzodioxol-5-ylmethylamino)-6-chloranyl-quinazolin-2-yl]oxyethanol

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethylamino)-6-chloranyl-quinazolin-2-yl]oxyethanol Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethylamino)-6-chloro-quinazolin-2-yl]oxyethanol CAS Name: 2-[[4-(1,3-benzodioxol-5-ylmethylamino)-6-chloro-2-quinazolinyl]oxy]ethanol IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethylamino)-6-chloroquinazolin-2-yl]oxyethanol Traditional Name: 2-[6-chloro-4-(piperonylamino)quinazolin-2-yl]oxyethanol Formula: C18H16ClN3O4 MolecularWeight: 373.79034

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16ClN3O4/c19-12-2-3-14-13(8-12)17(22-18(21-14)24-6-5-23)20-9-11-1-4-15-16(7-11)26-10-25-15/h1-4,7-8,23H,5-6,9-10H2,(H,20,21,22)