3-(1,3-benzodioxol-5-yl)-8-(dimethylaminomethyl)-2-methyl-7-oxidanyl-6-propyl-chromen-4-one hydrochloride

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-8-(dimethylaminomethyl)-2-methyl-7-oxidanyl-6-propyl-chromen-4-one hydrochloride Openeye Name: 3-(1,3-benzodioxol-5-yl)-8-(dimethylaminomethyl)-7-hydroxy-2-methyl-6-propyl-chromen-4-one hydrochloride CAS Name: 3-(1,3-benzodioxol-5-yl)-8-(dimethylaminomethyl)-7-hydroxy-2-methyl-6-propyl-1-benzopyran-4-one hydrochloride IUPAC Name: 3-(1,3-benzodioxol-5-yl)-8-(dimethylaminomethyl)-7-hydroxy-2-methyl-6-propylchromen-4-one hydrochloride Traditional Name: 3-(1,3-benzodioxol-5-yl)-8-(dimethylaminomethyl)-7-hydroxy-2-methyl-6-propyl-chromone hydrochloride Formula: C23H26ClNO5 MolecularWeight: 431.90924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C2C(=C1)C(=O)C(=C(O2)C)C3=CC4=C(C=C3)OCO4)CN(C)C)O.Cl

Isomeric SMILES

CCCC1=C(C(=C2C(=C1)C(=O)C(=C(O2)C)C3=CC4=C(C=C3)OCO4)CN(C)C)O.Cl

InChI

InChI=1S/C23H25NO5.ClH/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;1H