1-[(6,7-dimethoxy-3,4-dihydro-1H-isochromen-1-yl)methyl]-4-(3-methylphenyl)piperazine dihydrochloride

Systemtic Name: 1-[(6,7-dimethoxy-3,4-dihydro-1H-isochromen-1-yl)methyl]-4-(3-methylphenyl)piperazine dihydrochloride Openeye Name: 1-[(6,7-dimethoxyisochroman-1-yl)methyl]-4-(m-tolyl)piperazine dihydrochloride CAS Name: 1-[(6,7-dimethoxy-3,4-dihydro-1H-2-benzopyran-1-yl)methyl]-4-(3-methylphenyl)piperazine dihydrochloride IUPAC Name: 1-[(6,7-dimethoxy-3,4-dihydro-1H-isochromen-1-yl)methyl]-4-(3-methylphenyl)piperazine dihydrochloride Traditional Name: 1-[(6,7-dimethoxyisochroman-1-yl)methyl]-4-(m-tolyl)piperazine dihydrochloride Formula: C23H32Cl2N2O3 MolecularWeight: 455.41778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CC3C4=CC(=C(C=C4CCO3)OC)OC.Cl.Cl

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CC3C4=CC(=C(C=C4CCO3)OC)OC.Cl.Cl

InChI

InChI=1S/C23H30N2O3.2ClH/c1-17-5-4-6-19(13-17)25-10-8-24(9-11-25)16-23-20-15-22(27-3)21(26-2)14-18(20)7-12-28-23;;/h4-6,13-15,23H,7-12,16H2,1-3H3;2*1H