1-[3-(6,7-dimethoxy-1-methyl-3,4-dihydroisochromen-1-yl)propyl]-4-(2-methylphenyl)piperazine

Systemtic Name: 1-[3-(6,7-dimethoxy-1-methyl-3,4-dihydroisochromen-1-yl)propyl]-4-(2-methylphenyl)piperazine Openeye Name: 1-[3-(6,7-dimethoxy-1-methyl-isochroman-1-yl)propyl]-4-(o-tolyl)piperazine CAS Name: 1-[3-(6,7-dimethoxy-1-methyl-3,4-dihydro-1H-2-benzopyran-1-yl)propyl]-4-(2-methylphenyl)piperazine IUPAC Name: 1-[3-(6,7-dimethoxy-1-methyl-3,4-dihydroisochromen-1-yl)propyl]-4-(2-methylphenyl)piperazine Traditional Name: 1-[3-(6,7-dimethoxy-1-methyl-isochroman-1-yl)propyl]-4-(o-tolyl)piperazine Formula: C26H36N2O3 MolecularWeight: 424.57564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)CCCC3(C4=CC(=C(C=C4CCO3)OC)OC)C

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)CCCC3(C4=CC(=C(C=C4CCO3)OC)OC)C

InChI

InChI=1S/C26H36N2O3/c1-20-8-5-6-9-23(20)28-15-13-27(14-16-28)12-7-11-26(2)22-19-25(30-4)24(29-3)18-21(22)10-17-31-26/h5-6,8-9,18-19H,7,10-17H2,1-4H3