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

Systemtic Name: 2-[[4-(1,3-benzodioxol-5-ylmethylamino)-6-chloranyl-quinazolin-2-yl]-(2-hydroxyethyl)amino]ethanol Openeye Name: 2-[[4-(1,3-benzodioxol-5-ylmethylamino)-6-chloro-quinazolin-2-yl]-(2-hydroxyethyl)amino]ethanol CAS Name: 2-[[4-(1,3-benzodioxol-5-ylmethylamino)-6-chloro-2-quinazolinyl]-(2-hydroxyethyl)amino]ethanol IUPAC Name: 2-[[4-(1,3-benzodioxol-5-ylmethylamino)-6-chloroquinazolin-2-yl]-(2-hydroxyethyl)amino]ethanol Traditional Name: 2-[[6-chloro-4-(piperonylamino)quinazolin-2-yl]-(2-hydroxyethyl)amino]ethanol Formula: C20H21ClN4O4 MolecularWeight: 416.85814

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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)N(CCO)CCO

Isomeric SMILES

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

InChI

InChI=1S/C20H21ClN4O4/c21-14-2-3-16-15(10-14)19(24-20(23-16)25(5-7-26)6-8-27)22-11-13-1-4-17-18(9-13)29-12-28-17/h1-4,9-10,26-27H,5-8,11-12H2,(H,22,23,24)