[3-(1,3-benzodioxol-5-yl)-2-methyl-7-oxidanyl-4-oxidanylidene-6-propyl-chromen-8-yl]methyl-dimethyl-azanium

Systemtic Name: [3-(1,3-benzodioxol-5-yl)-2-methyl-7-oxidanyl-4-oxidanylidene-6-propyl-chromen-8-yl]methyl-dimethyl-azanium Openeye Name: [3-(1,3-benzodioxol-5-yl)-7-hydroxy-2-methyl-4-oxo-6-propyl-chromen-8-yl]methyl-dimethyl-ammonium CAS Name: [3-(1,3-benzodioxol-5-yl)-7-hydroxy-2-methyl-4-oxo-6-propyl-1-benzopyran-8-yl]methyl-dimethylammonium IUPAC Name: [3-(1,3-benzodioxol-5-yl)-7-hydroxy-2-methyl-4-oxo-6-propylchromen-8-yl]methyl-dimethylazanium Traditional Name: [3-(1,3-benzodioxol-5-yl)-7-hydroxy-4-keto-2-methyl-6-propyl-chromen-8-yl]methyl-dimethyl-ammonium Formula: C23H26NO5+ MolecularWeight: 396.45624

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C2C(=C1)C(=O)C(=C(O2)C)C3=CC4=C(C=C3)OCO4)C[NH+](C)C)O

Isomeric SMILES

CCCC1=C(C(=C2C(=C1)C(=O)C(=C(O2)C)C3=CC4=C(C=C3)OCO4)C[NH+](C)C)O

InChI

InChI=1S/C23H25NO5/c1-5-6-15-9-16-22(26)20(14-7-8-18-19(10-14)28-12-27-18)13(2)29-23(16)17(21(15)25)11-24(3)4/h7-10,25H,5-6,11-12H2,1-4H3/p+1