1-[2-(5,6-dimethoxy-3,4-dihydro-1H-isochromen-1-yl)ethyl]-4-pyridin-2-yl-piperazine

Systemtic Name: 1-[2-(5,6-dimethoxy-3,4-dihydro-1H-isochromen-1-yl)ethyl]-4-pyridin-2-yl-piperazine Openeye Name: 1-[2-(5,6-dimethoxyisochroman-1-yl)ethyl]-4-(2-pyridyl)piperazine CAS Name: 1-[2-(5,6-dimethoxy-3,4-dihydro-1H-2-benzopyran-1-yl)ethyl]-4-(2-pyridinyl)piperazine IUPAC Name: 1-[2-(5,6-dimethoxy-3,4-dihydro-1H-isochromen-1-yl)ethyl]-4-pyridin-2-ylpiperazine Traditional Name: 1-[2-(5,6-dimethoxyisochroman-1-yl)ethyl]-4-(2-pyridyl)piperazine Formula: C22H29N3O3 MolecularWeight: 383.48396

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(OCC2)CCN3CCN(CC3)C4=CC=CC=N4)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)C(OCC2)CCN3CCN(CC3)C4=CC=CC=N4)OC

InChI

InChI=1S/C22H29N3O3/c1-26-20-7-6-17-18(22(20)27-2)9-16-28-19(17)8-11-24-12-14-25(15-13-24)21-5-3-4-10-23-21/h3-7,10,19H,8-9,11-16H2,1-2H3