3-methyl-8-[6-(4-oxidanylpiperidin-1-yl)hexoxy]-2-phenyl-chromen-4-one hydrochloride

Systemtic Name: 3-methyl-8-[6-(4-oxidanylpiperidin-1-yl)hexoxy]-2-phenyl-chromen-4-one hydrochloride Openeye Name: 8-[6-(4-hydroxy-1-piperidyl)hexoxy]-3-methyl-2-phenyl-chromen-4-one hydrochloride CAS Name: 8-[6-(4-hydroxy-1-piperidinyl)hexoxy]-3-methyl-2-phenyl-1-benzopyran-4-one hydrochloride IUPAC Name: 8-[6-(4-hydroxypiperidin-1-yl)hexoxy]-3-methyl-2-phenylchromen-4-one hydrochloride Traditional Name: 8-[6-(4-hydroxypiperidino)hexoxy]-3-methyl-2-phenyl-chromone hydrochloride Formula: C27H34ClNO4 MolecularWeight: 472.01616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C(C1=O)C=CC=C2OCCCCCCN3CCC(CC3)O)C4=CC=CC=C4.Cl

Isomeric SMILES

CC1=C(OC2=C(C1=O)C=CC=C2OCCCCCCN3CCC(CC3)O)C4=CC=CC=C4.Cl

InChI

InChI=1S/C27H33NO4.ClH/c1-20-25(30)23-12-9-13-24(27(23)32-26(20)21-10-5-4-6-11-21)31-19-8-3-2-7-16-28-17-14-22(29)15-18-28;/h4-6,9-13,22,29H,2-3,7-8,14-19H2,1H3;1H