3-(3,5-dimethylphenoxy)-7-[3-(4-methylpiperidin-1-yl)-2-oxidanyl-propoxy]chromen-4-one hydrochloride

Systemtic Name: 3-(3,5-dimethylphenoxy)-7-[3-(4-methylpiperidin-1-yl)-2-oxidanyl-propoxy]chromen-4-one hydrochloride Openeye Name: 3-(3,5-dimethylphenoxy)-7-[2-hydroxy-3-(4-methyl-1-piperidyl)propoxy]chromen-4-one hydrochloride CAS Name: 3-(3,5-dimethylphenoxy)-7-[2-hydroxy-3-(4-methyl-1-piperidinyl)propoxy]-1-benzopyran-4-one hydrochloride IUPAC Name: 3-(3,5-dimethylphenoxy)-7-[2-hydroxy-3-(4-methylpiperidin-1-yl)propoxy]chromen-4-one hydrochloride Traditional Name: 3-(3,5-dimethylphenoxy)-7-[2-hydroxy-3-(4-methylpiperidino)propoxy]chromone hydrochloride Formula: C26H32ClNO5 MolecularWeight: 473.98898

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)CC(COC2=CC3=C(C=C2)C(=O)C(=CO3)OC4=CC(=CC(=C4)C)C)O.Cl

Isomeric SMILES

CC1CCN(CC1)CC(COC2=CC3=C(C=C2)C(=O)C(=CO3)OC4=CC(=CC(=C4)C)C)O.Cl

InChI

InChI=1S/C26H31NO5.ClH/c1-17-6-8-27(9-7-17)14-20(28)15-30-21-4-5-23-24(13-21)31-16-25(26(23)29)32-22-11-18(2)10-19(3)12-22;/h4-5,10-13,16-17,20,28H,6-9,14-15H2,1-3H3;1H