[3-(4-methoxyphenyl)-2-methyl-7-oxidanyl-4-oxidanylidene-chromen-8-yl]methyl-bis(2-methylpropyl)azanium

Systemtic Name: [3-(4-methoxyphenyl)-2-methyl-7-oxidanyl-4-oxidanylidene-chromen-8-yl]methyl-bis(2-methylpropyl)azanium Openeye Name: [7-hydroxy-3-(4-methoxyphenyl)-2-methyl-4-oxo-chromen-8-yl]methyl-diisobutyl-ammonium CAS Name: [7-hydroxy-3-(4-methoxyphenyl)-2-methyl-4-oxo-1-benzopyran-8-yl]methyl-bis(2-methylpropyl)ammonium IUPAC Name: [7-hydroxy-3-(4-methoxyphenyl)-2-methyl-4-oxochromen-8-yl]methyl-bis(2-methylpropyl)azanium Traditional Name: [7-hydroxy-4-keto-3-(4-methoxyphenyl)-2-methyl-chromen-8-yl]methyl-diisobutyl-ammonium Formula: C26H34NO4+ MolecularWeight: 424.55246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C(=C(C=C2)O)C[NH+](CC(C)C)CC(C)C)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C(=C(C=C2)O)C[NH+](CC(C)C)CC(C)C)C3=CC=C(C=C3)OC

InChI

InChI=1S/C26H33NO4/c1-16(2)13-27(14-17(3)4)15-22-23(28)12-11-21-25(29)24(18(5)31-26(21)22)19-7-9-20(30-6)10-8-19/h7-12,16-17,28H,13-15H2,1-6H3/p+1