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

Systemtic Name: [4-(4-azanyl-6-chloranyl-7-methoxy-quinazolin-2-yl)piperazin-1-yl]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone Openeye Name: [4-(4-amino-6-chloro-7-methoxy-quinazolin-2-yl)piperazin-1-yl]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone CAS Name: [4-(4-amino-6-chloro-7-methoxy-2-quinazolinyl)-1-piperazinyl]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone IUPAC Name: [4-(4-amino-6-chloro-7-methoxyquinazolin-2-yl)piperazin-1-yl]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone Traditional Name: [4-(4-amino-6-chloro-7-methoxy-quinazolin-2-yl)piperazino]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone Formula: C22H22ClN5O4 MolecularWeight: 455.89418

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=C(N=C2N)N3CCN(CC3)C(=O)C4COC5=CC=CC=C5O4)Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)N=C(N=C2N)N3CCN(CC3)C(=O)C4COC5=CC=CC=C5O4)Cl

InChI

InChI=1S/C22H22ClN5O4/c1-30-18-11-15-13(10-14(18)23)20(24)26-22(25-15)28-8-6-27(7-9-28)21(29)19-12-31-16-4-2-3-5-17(16)32-19/h2-5,10-11,19H,6-9,12H2,1H3,(H2,24,25,26)