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

Systemtic Name: 3-[6-[4-(4-chlorophenyl)piperazin-1-yl]hexoxy]-2-phenyl-chromen-4-one hydrochloride Openeye Name: 3-[6-[4-(4-chlorophenyl)piperazin-1-yl]hexoxy]-2-phenyl-chromen-4-one hydrochloride CAS Name: 3-[6-[4-(4-chlorophenyl)-1-piperazinyl]hexoxy]-2-phenyl-1-benzopyran-4-one hydrochloride IUPAC Name: 3-[6-[4-(4-chlorophenyl)piperazin-1-yl]hexoxy]-2-phenylchromen-4-one hydrochloride Traditional Name: 3-[6-[4-(4-chlorophenyl)piperazino]hexoxy]-2-phenyl-chromone hydrochloride Formula: C31H34Cl2N2O3 MolecularWeight: 553.51926

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCCCOC2=C(OC3=CC=CC=C3C2=O)C4=CC=CC=C4)C5=CC=C(C=C5)Cl.Cl

Isomeric SMILES

C1CN(CCN1CCCCCCOC2=C(OC3=CC=CC=C3C2=O)C4=CC=CC=C4)C5=CC=C(C=C5)Cl.Cl

InChI

InChI=1S/C31H33ClN2O3.ClH/c32-25-14-16-26(17-15-25)34-21-19-33(20-22-34)18-8-1-2-9-23-36-31-29(35)27-12-6-7-13-28(27)37-30(31)24-10-4-3-5-11-24;/h3-7,10-17H,1-2,8-9,18-23H2;1H