1-(4,4-diphenylbutyl)-4-[2-(1-ethyl-6,7-dimethoxy-3,4-dihydroisochromen-1-yl)ethyl]piperazine

Systemtic Name: 1-(4,4-diphenylbutyl)-4-[2-(1-ethyl-6,7-dimethoxy-3,4-dihydroisochromen-1-yl)ethyl]piperazine Openeye Name: 1-(4,4-diphenylbutyl)-4-[2-(1-ethyl-6,7-dimethoxy-isochroman-1-yl)ethyl]piperazine CAS Name: 1-(4,4-diphenylbutyl)-4-[2-(1-ethyl-6,7-dimethoxy-3,4-dihydro-1H-2-benzopyran-1-yl)ethyl]piperazine IUPAC Name: 1-(4,4-diphenylbutyl)-4-[2-(1-ethyl-6,7-dimethoxy-3,4-dihydroisochromen-1-yl)ethyl]piperazine Traditional Name: 1-(4,4-diphenylbutyl)-4-[2-(1-ethyl-6,7-dimethoxy-isochroman-1-yl)ethyl]piperazine Formula: C35H46N2O3 MolecularWeight: 542.75134

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C2=CC(=C(C=C2CCO1)OC)OC)CCN3CCN(CC3)CCCC(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCC1(C2=CC(=C(C=C2CCO1)OC)OC)CCN3CCN(CC3)CCCC(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C35H46N2O3/c1-4-35(32-27-34(39-3)33(38-2)26-30(32)17-25-40-35)18-20-37-23-21-36(22-24-37)19-11-16-31(28-12-7-5-8-13-28)29-14-9-6-10-15-29/h5-10,12-15,26-27,31H,4,11,16-25H2,1-3H3