4-(8-methoxy-2-oxidanylidene-chromen-3-yl)-8-[[methyl-(phenylmethyl)azaniumyl]methyl]-2-oxidanylidene-chromen-7-olate

Systemtic Name: 4-(8-methoxy-2-oxidanylidene-chromen-3-yl)-8-[[methyl-(phenylmethyl)azaniumyl]methyl]-2-oxidanylidene-chromen-7-olate Openeye Name: 8-[[benzyl(methyl)ammonio]methyl]-4-(8-methoxy-2-oxo-chromen-3-yl)-2-oxo-chromen-7-olate CAS Name: 4-(8-methoxy-2-oxo-1-benzopyran-3-yl)-8-[[methyl-(phenylmethyl)ammonio]methyl]-2-oxo-1-benzopyran-7-olate IUPAC Name: 8-[[benzyl(methyl)azaniumyl]methyl]-4-(8-methoxy-2-oxochromen-3-yl)-2-oxochromen-7-olate Traditional Name: 8-[[benzyl(methyl)ammonio]methyl]-2-keto-4-(2-keto-8-methoxy-chromen-3-yl)chromen-7-olate Formula: C28H23NO6 MolecularWeight: 469.48532

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)CC2=C(C=CC3=C2OC(=O)C=C3C4=CC5=C(C(=CC=C5)OC)OC4=O)[O-]

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)CC2=C(C=CC3=C2OC(=O)C=C3C4=CC5=C(C(=CC=C5)OC)OC4=O)[O-]

InChI

InChI=1S/C28H23NO6/c1-29(15-17-7-4-3-5-8-17)16-22-23(30)12-11-19-20(14-25(31)34-27(19)22)21-13-18-9-6-10-24(33-2)26(18)35-28(21)32/h3-14,30H,15-16H2,1-2H3