8-[[bis(2-methylpropyl)azaniumyl]methyl]-4-oxidanylidene-3-phenyl-chromen-7-olate

Systemtic Name: 8-[[bis(2-methylpropyl)azaniumyl]methyl]-4-oxidanylidene-3-phenyl-chromen-7-olate Openeye Name: 8-[(diisobutylammonio)methyl]-4-oxo-3-phenyl-chromen-7-olate CAS Name: 8-[[bis(2-methylpropyl)ammonio]methyl]-4-oxo-3-phenyl-1-benzopyran-7-olate IUPAC Name: 8-[[bis(2-methylpropyl)azaniumyl]methyl]-4-oxo-3-phenylchromen-7-olate Traditional Name: 8-[(diisobutylammonio)methyl]-4-keto-3-phenyl-chromen-7-olate Formula: C24H29NO3 MolecularWeight: 379.49196

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH+](CC1=C(C=CC2=C1OC=C(C2=O)C3=CC=CC=C3)[O-])CC(C)C

Isomeric SMILES

CC(C)C[NH+](CC1=C(C=CC2=C1OC=C(C2=O)C3=CC=CC=C3)[O-])CC(C)C

InChI

InChI=1S/C24H29NO3/c1-16(2)12-25(13-17(3)4)14-20-22(26)11-10-19-23(27)21(15-28-24(19)20)18-8-6-5-7-9-18/h5-11,15-17,26H,12-14H2,1-4H3