3-(4-methoxyphenyl)-8-[[methyl-(phenylmethyl)azaniumyl]methyl]-4-oxidanylidene-chromen-7-olate

Systemtic Name: 3-(4-methoxyphenyl)-8-[[methyl-(phenylmethyl)azaniumyl]methyl]-4-oxidanylidene-chromen-7-olate Openeye Name: 8-[[benzyl(methyl)ammonio]methyl]-3-(4-methoxyphenyl)-4-oxo-chromen-7-olate CAS Name: 3-(4-methoxyphenyl)-8-[[methyl-(phenylmethyl)ammonio]methyl]-4-oxo-1-benzopyran-7-olate IUPAC Name: 8-[[benzyl(methyl)azaniumyl]methyl]-3-(4-methoxyphenyl)-4-oxochromen-7-olate Traditional Name: 8-[[benzyl(methyl)ammonio]methyl]-4-keto-3-(4-methoxyphenyl)chromen-7-olate Formula: C25H23NO4 MolecularWeight: 401.45442

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)CC2=C(C=CC3=C2OC=C(C3=O)C4=CC=C(C=C4)OC)[O-]

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)CC2=C(C=CC3=C2OC=C(C3=O)C4=CC=C(C=C4)OC)[O-]

InChI

InChI=1S/C25H23NO4/c1-26(14-17-6-4-3-5-7-17)15-21-23(27)13-12-20-24(28)22(16-30-25(20)21)18-8-10-19(29-2)11-9-18/h3-13,16,27H,14-15H2,1-2H3