4-[[bis(2-methylpropyl)azaniumyl]methyl]-7-methyl-2-oxidanylidene-chromen-6-olate

Systemtic Name: 4-[[bis(2-methylpropyl)azaniumyl]methyl]-7-methyl-2-oxidanylidene-chromen-6-olate Openeye Name: 4-[(diisobutylammonio)methyl]-7-methyl-2-oxo-chromen-6-olate CAS Name: 4-[[bis(2-methylpropyl)ammonio]methyl]-7-methyl-2-oxo-1-benzopyran-6-olate IUPAC Name: 4-[[bis(2-methylpropyl)azaniumyl]methyl]-7-methyl-2-oxochromen-6-olate Traditional Name: 4-[(diisobutylammonio)methyl]-2-keto-7-methyl-chromen-6-olate Formula: C19H27NO3 MolecularWeight: 317.42258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)C[NH+](CC(C)C)CC(C)C)[O-]

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)C[NH+](CC(C)C)CC(C)C)[O-]

InChI

InChI=1S/C19H27NO3/c1-12(2)9-20(10-13(3)4)11-15-7-19(22)23-18-6-14(5)17(21)8-16(15)18/h6-8,12-13,21H,9-11H2,1-5H3