2-(4-bromanylphenoxy)-5-[[6-methoxy-7-(2-methoxyethoxy)quinazolin-4-yl]amino]cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2-(4-bromanylphenoxy)-5-[[6-methoxy-7-(2-methoxyethoxy)quinazolin-4-yl]amino]cyclohexa-2,5-diene-1,4-dione Openeye Name: 2-(4-bromophenoxy)-5-[[6-methoxy-7-(2-methoxyethoxy)quinazolin-4-yl]amino]-1,4-benzoquinone CAS Name: 2-(4-bromophenoxy)-5-[[6-methoxy-7-(2-methoxyethoxy)-4-quinazolinyl]amino]cyclohexa-2,5-diene-1,4-dione IUPAC Name: 2-(4-bromophenoxy)-5-[[6-methoxy-7-(2-methoxyethoxy)quinazolin-4-yl]amino]cyclohexa-2,5-diene-1,4-dione Traditional Name: 2-(4-bromophenoxy)-5-[[6-methoxy-7-(2-methoxyethoxy)quinazolin-4-yl]amino]-p-benzoquinone Formula: C24H20BrN3O6 MolecularWeight: 526.3361

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C2C(=C1)N=CN=C2NC3=CC(=O)C(=CC3=O)OC4=CC=C(C=C4)Br)OC

Isomeric SMILES

COCCOC1=C(C=C2C(=C1)N=CN=C2NC3=CC(=O)C(=CC3=O)OC4=CC=C(C=C4)Br)OC

InChI

InChI=1S/C24H20BrN3O6/c1-31-7-8-33-23-11-17-16(9-22(23)32-2)24(27-13-26-17)28-18-10-20(30)21(12-19(18)29)34-15-5-3-14(25)4-6-15/h3-6,9-13H,7-8H2,1-2H3,(H,26,27,28)