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

Systemtic Name: 2-(2-chlorophenyl)-6-[6-(4-oxidanylpiperidin-1-yl)hexoxy]chromen-4-one hydrochloride Openeye Name: 2-(2-chlorophenyl)-6-[6-(4-hydroxy-1-piperidyl)hexoxy]chromen-4-one hydrochloride CAS Name: 2-(2-chlorophenyl)-6-[6-(4-hydroxy-1-piperidinyl)hexoxy]-1-benzopyran-4-one hydrochloride IUPAC Name: 2-(2-chlorophenyl)-6-[6-(4-hydroxypiperidin-1-yl)hexoxy]chromen-4-one hydrochloride Traditional Name: 2-(2-chlorophenyl)-6-[6-(4-hydroxypiperidino)hexoxy]chromone hydrochloride Formula: C26H31Cl2NO4 MolecularWeight: 492.43464

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1O)CCCCCCOC2=CC3=C(C=C2)OC(=CC3=O)C4=CC=CC=C4Cl.Cl

Isomeric SMILES

C1CN(CCC1O)CCCCCCOC2=CC3=C(C=C2)OC(=CC3=O)C4=CC=CC=C4Cl.Cl

InChI

InChI=1S/C26H30ClNO4.ClH/c27-23-8-4-3-7-21(23)26-18-24(30)22-17-20(9-10-25(22)32-26)31-16-6-2-1-5-13-28-14-11-19(29)12-15-28;/h3-4,7-10,17-19,29H,1-2,5-6,11-16H2;1H