bis[2,3-bis(3-hydroxyphenyl)quinoxalin-5-yl]methanone

Systemtic Name: bis[2,3-bis(3-hydroxyphenyl)quinoxalin-5-yl]methanone Openeye Name: bis[2,3-bis(3-hydroxyphenyl)quinoxalin-5-yl]methanone CAS Name: bis[2,3-bis(3-hydroxyphenyl)-5-quinoxalinyl]methanone IUPAC Name: bis[2,3-bis(3-hydroxyphenyl)quinoxalin-5-yl]methanone Traditional Name: bis[2,3-bis(3-hydroxyphenyl)quinoxalin-5-yl]methanone Formula: C41H26N4O5 MolecularWeight: 654.66894

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)O)C2=NC3=CC=CC(=C3N=C2C4=CC(=CC=C4)O)C(=O)C5=C6C(=CC=C5)N=C(C(=N6)C7=CC(=CC=C7)O)C8=CC(=CC=C8)O

Isomeric SMILES

C1=CC(=CC(=C1)O)C2=NC3=CC=CC(=C3N=C2C4=CC(=CC=C4)O)C(=O)C5=C6C(=CC=C5)N=C(C(=N6)C7=CC(=CC=C7)O)C8=CC(=CC=C8)O

InChI

InChI=1S/C41H26N4O5/c46-27-11-1-7-23(19-27)35-37(25-9-3-13-29(48)21-25)44-39-31(15-5-17-33(39)42-35)41(50)32-16-6-18-34-40(32)45-38(26-10-4-14-30(49)22-26)36(43-34)24-8-2-12-28(47)20-24/h1-22,46-49H