6,8-bis(morpholin-4-ium-4-ylmethyl)-4-oxidanylidene-2-phenyl-chromene-5,7-diolate

Systemtic Name: 6,8-bis(morpholin-4-ium-4-ylmethyl)-4-oxidanylidene-2-phenyl-chromene-5,7-diolate Openeye Name: 6,8-bis(morpholin-4-ium-4-ylmethyl)-4-oxo-2-phenyl-chromene-5,7-diolate CAS Name: 6,8-bis(4-morpholin-4-iumylmethyl)-4-oxo-2-phenyl-1-benzopyran-5,7-diolate IUPAC Name: 6,8-bis(morpholin-4-ium-4-ylmethyl)-4-oxo-2-phenylchromene-5,7-diolate Traditional Name: 4-keto-6,8-bis(morpholin-4-ium-4-ylmethyl)-2-phenyl-chromene-5,7-diolate Formula: C25H28N2O6 MolecularWeight: 452.49962

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=C(C(=C3C(=C2[O-])C(=O)C=C(O3)C4=CC=CC=C4)C[NH+]5CCOCC5)[O-]

Isomeric SMILES

C1COCC[NH+]1CC2=C(C(=C3C(=C2[O-])C(=O)C=C(O3)C4=CC=CC=C4)C[NH+]5CCOCC5)[O-]

InChI

InChI=1S/C25H28N2O6/c28-20-14-21(17-4-2-1-3-5-17)33-25-19(16-27-8-12-32-13-9-27)23(29)18(24(30)22(20)25)15-26-6-10-31-11-7-26/h1-5,14,29-30H,6-13,15-16H2