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

Systemtic Name: [3-(3,4-dimethoxyphenyl)-7-oxidanyl-2-oxidanylidene-chromen-8-yl]methyl-(2-methylpropyl)azanium Openeye Name: [3-(3,4-dimethoxyphenyl)-7-hydroxy-2-oxo-chromen-8-yl]methyl-isobutyl-ammonium CAS Name: [3-(3,4-dimethoxyphenyl)-7-hydroxy-2-oxo-1-benzopyran-8-yl]methyl-(2-methylpropyl)ammonium IUPAC Name: [3-(3,4-dimethoxyphenyl)-7-hydroxy-2-oxochromen-8-yl]methyl-(2-methylpropyl)azanium Traditional Name: [3-(3,4-dimethoxyphenyl)-7-hydroxy-2-keto-chromen-8-yl]methyl-isobutyl-ammonium Formula: C22H26NO5+ MolecularWeight: 384.44554

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH2+]CC1=C(C=CC2=C1OC(=O)C(=C2)C3=CC(=C(C=C3)OC)OC)O

Isomeric SMILES

CC(C)C[NH2+]CC1=C(C=CC2=C1OC(=O)C(=C2)C3=CC(=C(C=C3)OC)OC)O

InChI

InChI=1S/C22H25NO5/c1-13(2)11-23-12-17-18(24)7-5-15-9-16(22(25)28-21(15)17)14-6-8-19(26-3)20(10-14)27-4/h5-10,13,23-24H,11-12H2,1-4H3/p+1