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

Systemtic Name: 3-[6-[4-(2-hydroxyethyl)piperazin-1-yl]hexoxy]-2-phenyl-chromen-4-one hydrochloride Openeye Name: 3-[6-[4-(2-hydroxyethyl)piperazin-1-yl]hexoxy]-2-phenyl-chromen-4-one hydrochloride CAS Name: 3-[6-[4-(2-hydroxyethyl)-1-piperazinyl]hexoxy]-2-phenyl-1-benzopyran-4-one hydrochloride IUPAC Name: 3-[6-[4-(2-hydroxyethyl)piperazin-1-yl]hexoxy]-2-phenylchromen-4-one hydrochloride Traditional Name: 3-[6-[4-(2-hydroxyethyl)piperazino]hexoxy]-2-phenyl-chromone hydrochloride Formula: C27H35ClN2O4 MolecularWeight: 487.0308

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCCCOC2=C(OC3=CC=CC=C3C2=O)C4=CC=CC=C4)CCO.Cl

Isomeric SMILES

C1CN(CCN1CCCCCCOC2=C(OC3=CC=CC=C3C2=O)C4=CC=CC=C4)CCO.Cl

InChI

InChI=1S/C27H34N2O4.ClH/c30-20-19-29-17-15-28(16-18-29)14-8-1-2-9-21-32-27-25(31)23-12-6-7-13-24(23)33-26(27)22-10-4-3-5-11-22;/h3-7,10-13,30H,1-2,8-9,14-21H2;1H