2-[3,4-bis(oxidanyl)phenyl]-6,8-bis(morpholin-4-ium-4-ylmethyl)-3,5,7-tris(oxidanyl)chromen-4-one dichloride

Systemtic Name: 2-[3,4-bis(oxidanyl)phenyl]-6,8-bis(morpholin-4-ium-4-ylmethyl)-3,5,7-tris(oxidanyl)chromen-4-one dichloride Openeye Name: 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-6,8-bis(morpholin-4-ium-4-ylmethyl)chromen-4-one dichloride CAS Name: 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-6,8-bis(4-morpholin-4-iumylmethyl)-1-benzopyran-4-one dichloride IUPAC Name: 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-6,8-bis(morpholin-4-ium-4-ylmethyl)chromen-4-one dichloride Traditional Name: 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-6,8-bis(morpholin-4-ium-4-ylmethyl)chromone dichloride Formula: C25H30Cl2N2O9 MolecularWeight: 573.4197

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=C(C3=C(C(=C2O)C[NH+]4CCOCC4)OC(=C(C3=O)O)C5=CC(=C(C=C5)O)O)O.[Cl-].[Cl-]

Isomeric SMILES

C1COCC[NH+]1CC2=C(C3=C(C(=C2O)C[NH+]4CCOCC4)OC(=C(C3=O)O)C5=CC(=C(C=C5)O)O)O.[Cl-].[Cl-]

InChI

InChI=1S/C25H28N2O9.2ClH/c28-17-2-1-14(11-18(17)29)24-23(33)22(32)19-21(31)15(12-26-3-7-34-8-4-26)20(30)16(25(19)36-24)13-27-5-9-35-10-6-27;;/h1-2,11,28-31,33H,3-10,12-13H2;2*1H