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

Systemtic Name: 8-[[butyl(methyl)azaniumyl]methyl]-4-(8-methoxy-2-oxidanylidene-chromen-3-yl)-2-oxidanylidene-chromen-7-olate Openeye Name: 8-[[butyl(methyl)ammonio]methyl]-4-(8-methoxy-2-oxo-chromen-3-yl)-2-oxo-chromen-7-olate CAS Name: 8-[[butyl(methyl)ammonio]methyl]-4-(8-methoxy-2-oxo-1-benzopyran-3-yl)-2-oxo-1-benzopyran-7-olate IUPAC Name: 8-[[butyl(methyl)azaniumyl]methyl]-4-(8-methoxy-2-oxochromen-3-yl)-2-oxochromen-7-olate Traditional Name: 8-[[butyl(methyl)ammonio]methyl]-2-keto-4-(2-keto-8-methoxy-chromen-3-yl)chromen-7-olate Formula: C25H25NO6 MolecularWeight: 435.4691

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C)CC1=C(C=CC2=C1OC(=O)C=C2C3=CC4=C(C(=CC=C4)OC)OC3=O)[O-]

Isomeric SMILES

CCCC[NH+](C)CC1=C(C=CC2=C1OC(=O)C=C2C3=CC4=C(C(=CC=C4)OC)OC3=O)[O-]

InChI

InChI=1S/C25H25NO6/c1-4-5-11-26(2)14-19-20(27)10-9-16-17(13-22(28)31-24(16)19)18-12-15-7-6-8-21(30-3)23(15)32-25(18)29/h6-10,12-13,27H,4-5,11,14H2,1-3H3