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

Systemtic Name: [3-(2-methoxyphenyl)-7-oxidanyl-4-oxidanylidene-chromen-8-yl]methyl-bis(2-methylpropyl)azanium Openeye Name: [7-hydroxy-3-(2-methoxyphenyl)-4-oxo-chromen-8-yl]methyl-diisobutyl-ammonium CAS Name: [7-hydroxy-3-(2-methoxyphenyl)-4-oxo-1-benzopyran-8-yl]methyl-bis(2-methylpropyl)ammonium IUPAC Name: [7-hydroxy-3-(2-methoxyphenyl)-4-oxochromen-8-yl]methyl-bis(2-methylpropyl)azanium Traditional Name: [7-hydroxy-4-keto-3-(2-methoxyphenyl)chromen-8-yl]methyl-diisobutyl-ammonium Formula: C25H32NO4+ MolecularWeight: 410.52588

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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=C3OC)O)CC(C)C

Isomeric SMILES

CC(C)C[NH+](CC1=C(C=CC2=C1OC=C(C2=O)C3=CC=CC=C3OC)O)CC(C)C

InChI

InChI=1S/C25H31NO4/c1-16(2)12-26(13-17(3)4)14-20-22(27)11-10-19-24(28)21(15-30-25(19)20)18-8-6-7-9-23(18)29-5/h6-11,15-17,27H,12-14H2,1-5H3/p+1