6-[6-(4-oxidanylpiperidin-1-yl)hexoxy]-2-pyridin-3-yl-chromen-4-one hydrochloride

Systemtic Name: 6-[6-(4-oxidanylpiperidin-1-yl)hexoxy]-2-pyridin-3-yl-chromen-4-one hydrochloride Openeye Name: 6-[6-(4-hydroxy-1-piperidyl)hexoxy]-2-(3-pyridyl)chromen-4-one hydrochloride CAS Name: 6-[6-(4-hydroxy-1-piperidinyl)hexoxy]-2-(3-pyridinyl)-1-benzopyran-4-one hydrochloride IUPAC Name: 6-[6-(4-hydroxypiperidin-1-yl)hexoxy]-2-pyridin-3-ylchromen-4-one hydrochloride Traditional Name: 6-[6-(4-hydroxypiperidino)hexoxy]-2-(3-pyridyl)chromone hydrochloride Formula: C25H31ClN2O4 MolecularWeight: 458.97764

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1O)CCCCCCOC2=CC3=C(C=C2)OC(=CC3=O)C4=CN=CC=C4.Cl

Isomeric SMILES

C1CN(CCC1O)CCCCCCOC2=CC3=C(C=C2)OC(=CC3=O)C4=CN=CC=C4.Cl

InChI

InChI=1S/C25H30N2O4.ClH/c28-20-9-13-27(14-10-20)12-3-1-2-4-15-30-21-7-8-24-22(16-21)23(29)17-25(31-24)19-6-5-11-26-18-19;/h5-8,11,16-18,20,28H,1-4,9-10,12-15H2;1H