[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)-2-oxidanyl-piperazin-1-yl]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone

Systemtic Name: [4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)-2-oxidanyl-piperazin-1-yl]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone Openeye Name: [4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)-2-hydroxy-piperazin-1-yl]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone CAS Name: [4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-2-hydroxy-1-piperazinyl]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone IUPAC Name: [4-(4-amino-6,7-dimethoxyquinazolin-2-yl)-2-hydroxypiperazin-1-yl]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone Traditional Name: [4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)-2-hydroxy-piperazino]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone Formula: C23H25N5O6 MolecularWeight: 467.4745

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(C(C3)O)C(=O)C4COC5=CC=CC=C5O4)N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(C(C3)O)C(=O)C4COC5=CC=CC=C5O4)N)OC

InChI

InChI=1S/C23H25N5O6/c1-31-17-9-13-14(10-18(17)32-2)25-23(26-21(13)24)27-7-8-28(20(29)11-27)22(30)19-12-33-15-5-3-4-6-16(15)34-19/h3-6,9-10,19-20,29H,7-8,11-12H2,1-2H3,(H2,24,25,26)