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

Systemtic Name: 3-[4-(1,3-benzodioxol-5-ylmethylamino)-6-chloranyl-quinazolin-2-yl]oxypropan-1-ol Openeye Name: 3-[4-(1,3-benzodioxol-5-ylmethylamino)-6-chloro-quinazolin-2-yl]oxypropan-1-ol CAS Name: 3-[[4-(1,3-benzodioxol-5-ylmethylamino)-6-chloro-2-quinazolinyl]oxy]-1-propanol IUPAC Name: 3-[4-(1,3-benzodioxol-5-ylmethylamino)-6-chloroquinazolin-2-yl]oxypropan-1-ol Traditional Name: 3-[6-chloro-4-(piperonylamino)quinazolin-2-yl]oxypropan-1-ol Formula: C19H18ClN3O4 MolecularWeight: 387.81692

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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)OCCCO

Isomeric SMILES

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

InChI

InChI=1S/C19H18ClN3O4/c20-13-3-4-15-14(9-13)18(23-19(22-15)25-7-1-6-24)21-10-12-2-5-16-17(8-12)27-11-26-16/h2-5,8-9,24H,1,6-7,10-11H2,(H,21,22,23)