1-[2-(6-bromanyl-3,4-dihydro-1H-isochromen-1-yl)ethyl]-4-(4-methoxyphenyl)piperazine dihydrochloride

Systemtic Name: 1-[2-(6-bromanyl-3,4-dihydro-1H-isochromen-1-yl)ethyl]-4-(4-methoxyphenyl)piperazine dihydrochloride Openeye Name: 1-[2-(6-bromoisochroman-1-yl)ethyl]-4-(4-methoxyphenyl)piperazine dihydrochloride CAS Name: 1-[2-(6-bromo-3,4-dihydro-1H-2-benzopyran-1-yl)ethyl]-4-(4-methoxyphenyl)piperazine dihydrochloride IUPAC Name: 1-[2-(6-bromo-3,4-dihydro-1H-isochromen-1-yl)ethyl]-4-(4-methoxyphenyl)piperazine dihydrochloride Traditional Name: 1-[2-(6-bromoisochroman-1-yl)ethyl]-4-(4-methoxyphenyl)piperazine dihydrochloride Formula: C22H29BrCl2N2O2 MolecularWeight: 504.28786

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)CCC3C4=C(CCO3)C=C(C=C4)Br.Cl.Cl

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)CCC3C4=C(CCO3)C=C(C=C4)Br.Cl.Cl

InChI

InChI=1S/C22H27BrN2O2.2ClH/c1-26-20-5-3-19(4-6-20)25-13-11-24(12-14-25)10-8-22-21-7-2-18(23)16-17(21)9-15-27-22;;/h2-7,16,22H,8-15H2,1H3;2*1H