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

Systemtic Name: 1-[(6,7-dimethoxy-3,4-dihydro-1H-isochromen-1-yl)methyl]-4-(4,4-diphenylbutyl)piperazine Openeye Name: 1-[(6,7-dimethoxyisochroman-1-yl)methyl]-4-(4,4-diphenylbutyl)piperazine CAS Name: 1-[(6,7-dimethoxy-3,4-dihydro-1H-2-benzopyran-1-yl)methyl]-4-(4,4-diphenylbutyl)piperazine IUPAC Name: 1-[(6,7-dimethoxy-3,4-dihydro-1H-isochromen-1-yl)methyl]-4-(4,4-diphenylbutyl)piperazine Traditional Name: 1-[(6,7-dimethoxyisochroman-1-yl)methyl]-4-(4,4-diphenylbutyl)piperazine Formula: C32H40N2O3 MolecularWeight: 500.6716

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(OCCC2=C1)CN3CCN(CC3)CCCC(C4=CC=CC=C4)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C2C(OCCC2=C1)CN3CCN(CC3)CCCC(C4=CC=CC=C4)C5=CC=CC=C5)OC

InChI

InChI=1S/C32H40N2O3/c1-35-30-22-27-15-21-37-32(29(27)23-31(30)36-2)24-34-19-17-33(18-20-34)16-9-14-28(25-10-5-3-6-11-25)26-12-7-4-8-13-26/h3-8,10-13,22-23,28,32H,9,14-21,24H2,1-2H3