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

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-8-(dimethylaminomethyl)-7-oxidanyl-6-propyl-chromen-4-one hydrochloride Openeye Name: 3-(1,3-benzodioxol-5-yl)-8-(dimethylaminomethyl)-7-hydroxy-6-propyl-chromen-4-one hydrochloride CAS Name: 3-(1,3-benzodioxol-5-yl)-8-(dimethylaminomethyl)-7-hydroxy-6-propyl-1-benzopyran-4-one hydrochloride IUPAC Name: 3-(1,3-benzodioxol-5-yl)-8-(dimethylaminomethyl)-7-hydroxy-6-propylchromen-4-one hydrochloride Traditional Name: 3-(1,3-benzodioxol-5-yl)-8-(dimethylaminomethyl)-7-hydroxy-6-propyl-chromone hydrochloride Formula: C22H24ClNO5 MolecularWeight: 417.88266

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C2C(=C1)C(=O)C(=CO2)C3=CC4=C(C=C3)OCO4)CN(C)C)O.Cl

Isomeric SMILES

CCCC1=C(C(=C2C(=C1)C(=O)C(=CO2)C3=CC4=C(C=C3)OCO4)CN(C)C)O.Cl

InChI

InChI=1S/C22H23NO5.ClH/c1-4-5-14-8-15-21(25)17(13-6-7-18-19(9-13)28-12-27-18)11-26-22(15)16(20(14)24)10-23(2)3;/h6-9,11,24H,4-5,10,12H2,1-3H3;1H