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

Systemtic Name: 2-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)-1-(2,3-dihydro-1,4-benzodioxin-3-ylcarbonyl)piperazin-2-yl]ethanoate Openeye Name: 2-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)-1-(2,3-dihydro-1,4-benzodioxine-3-carbonyl)piperazin-2-yl]acetate CAS Name: 2-[4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1-[2,3-dihydro-1,4-benzodioxin-3-yl(oxo)methyl]-2-piperazinyl]acetate IUPAC Name: 2-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)-1-(2,3-dihydro-1,4-benzodioxine-3-carbonyl)piperazin-2-yl]acetate Traditional Name: 2-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)-1-(2,3-dihydro-1,4-benzodioxin-3-carbonyl)piperazin-2-yl]acetate Formula: C25H26N5O7- MolecularWeight: 508.50324

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H27N5O7/c1-34-19-10-15-16(11-20(19)35-2)27-25(28-23(15)26)29-7-8-30(14(12-29)9-22(31)32)24(33)21-13-36-17-5-3-4-6-18(17)37-21/h3-6,10-11,14,21H,7-9,12-13H2,1-2H3,(H,31,32)(H2,26,27,28)/p-1