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

Systemtic Name: 6-[6-(3-oxidanylpiperidin-1-yl)hexoxy]-2-phenyl-chromen-4-one hydrochloride Openeye Name: 6-[6-(3-hydroxy-1-piperidyl)hexoxy]-2-phenyl-chromen-4-one hydrochloride CAS Name: 6-[6-(3-hydroxy-1-piperidinyl)hexoxy]-2-phenyl-1-benzopyran-4-one hydrochloride IUPAC Name: 6-[6-(3-hydroxypiperidin-1-yl)hexoxy]-2-phenylchromen-4-one hydrochloride Traditional Name: 6-[6-(3-hydroxypiperidino)hexoxy]-2-phenyl-chromone hydrochloride Formula: C26H32ClNO4 MolecularWeight: 457.98958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCCCCCOC2=CC3=C(C=C2)OC(=CC3=O)C4=CC=CC=C4)O.Cl

Isomeric SMILES

C1CC(CN(C1)CCCCCCOC2=CC3=C(C=C2)OC(=CC3=O)C4=CC=CC=C4)O.Cl

InChI

InChI=1S/C26H31NO4.ClH/c28-21-11-8-15-27(19-21)14-6-1-2-7-16-30-22-12-13-25-23(17-22)24(29)18-26(31-25)20-9-4-3-5-10-20;/h3-5,9-10,12-13,17-18,21,28H,1-2,6-8,11,14-16,19H2;1H