4-[[(3,5-dimethylphenyl)azaniumyl]methyl]-7-methyl-2-oxidanylidene-chromen-6-olate

Systemtic Name: 4-[[(3,5-dimethylphenyl)azaniumyl]methyl]-7-methyl-2-oxidanylidene-chromen-6-olate Openeye Name: 4-[[(3,5-dimethylphenyl)ammonio]methyl]-7-methyl-2-oxo-chromen-6-olate CAS Name: 4-[[(3,5-dimethylphenyl)ammonio]methyl]-7-methyl-2-oxo-1-benzopyran-6-olate IUPAC Name: 4-[[(3,5-dimethylphenyl)azaniumyl]methyl]-7-methyl-2-oxochromen-6-olate Traditional Name: 4-[[(3,5-dimethylphenyl)ammonio]methyl]-2-keto-7-methyl-chromen-6-olate Formula: C19H19NO3 MolecularWeight: 309.35906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)[NH2+]CC2=CC(=O)OC3=CC(=C(C=C23)[O-])C)C

Isomeric SMILES

CC1=CC(=CC(=C1)[NH2+]CC2=CC(=O)OC3=CC(=C(C=C23)[O-])C)C

InChI

InChI=1S/C19H19NO3/c1-11-4-12(2)6-15(5-11)20-10-14-8-19(22)23-18-7-13(3)17(21)9-16(14)18/h4-9,20-21H,10H2,1-3H3