4-[(2,3-dihydro-1,4-benzodioxin-6-ylazaniumyl)methyl]-2-oxidanylidene-7-phenyl-chromen-6-olate

Systemtic Name: 4-[(2,3-dihydro-1,4-benzodioxin-6-ylazaniumyl)methyl]-2-oxidanylidene-7-phenyl-chromen-6-olate Openeye Name: 4-[(2,3-dihydro-1,4-benzodioxin-6-ylammonio)methyl]-2-oxo-7-phenyl-chromen-6-olate CAS Name: 4-[(2,3-dihydro-1,4-benzodioxin-6-ylammonio)methyl]-2-oxo-7-phenyl-1-benzopyran-6-olate IUPAC Name: 4-[(2,3-dihydro-1,4-benzodioxin-6-ylazaniumyl)methyl]-2-oxo-7-phenylchromen-6-olate Traditional Name: 4-[(2,3-dihydro-1,4-benzodioxin-6-ylammonio)methyl]-2-keto-7-phenyl-chromen-6-olate Formula: C24H19NO5 MolecularWeight: 401.41136

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)[NH2+]CC3=CC(=O)OC4=CC(=C(C=C34)[O-])C5=CC=CC=C5

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)[NH2+]CC3=CC(=O)OC4=CC(=C(C=C34)[O-])C5=CC=CC=C5

InChI

InChI=1S/C24H19NO5/c26-20-12-19-16(14-25-17-6-7-21-23(11-17)29-9-8-28-21)10-24(27)30-22(19)13-18(20)15-4-2-1-3-5-15/h1-7,10-13,25-26H,8-9,14H2