2-[[4-(1,3-benzodioxol-5-ylmethylamino)-6,7,8-trimethoxy-quinazolin-2-yl]amino]ethanol

Systemtic Name: 2-[[4-(1,3-benzodioxol-5-ylmethylamino)-6,7,8-trimethoxy-quinazolin-2-yl]amino]ethanol Openeye Name: 2-[[4-(1,3-benzodioxol-5-ylmethylamino)-6,7,8-trimethoxy-quinazolin-2-yl]amino]ethanol CAS Name: 2-[[4-(1,3-benzodioxol-5-ylmethylamino)-6,7,8-trimethoxy-2-quinazolinyl]amino]ethanol IUPAC Name: 2-[[4-(1,3-benzodioxol-5-ylmethylamino)-6,7,8-trimethoxyquinazolin-2-yl]amino]ethanol Traditional Name: 2-[[6,7,8-trimethoxy-4-(piperonylamino)quinazolin-2-yl]amino]ethanol Formula: C21H24N4O6 MolecularWeight: 428.43846

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C(=C1)C(=NC(=N2)NCCO)NCC3=CC4=C(C=C3)OCO4)OC)OC

Isomeric SMILES

COC1=C(C(=C2C(=C1)C(=NC(=N2)NCCO)NCC3=CC4=C(C=C3)OCO4)OC)OC

InChI

InChI=1S/C21H24N4O6/c1-27-16-9-13-17(19(29-3)18(16)28-2)24-21(22-6-7-26)25-20(13)23-10-12-4-5-14-15(8-12)31-11-30-14/h4-5,8-9,26H,6-7,10-11H2,1-3H3,(H2,22,23,24,25)