1-[(6,7-dimethoxy-3,4-dihydro-1H-isochromen-1-yl)methyl]-4-pyridin-2-yl-piperazine

Systemtic Name: 1-[(6,7-dimethoxy-3,4-dihydro-1H-isochromen-1-yl)methyl]-4-pyridin-2-yl-piperazine Openeye Name: 1-[(6,7-dimethoxyisochroman-1-yl)methyl]-4-(2-pyridyl)piperazine CAS Name: 1-[(6,7-dimethoxy-3,4-dihydro-1H-2-benzopyran-1-yl)methyl]-4-(2-pyridinyl)piperazine IUPAC Name: 1-[(6,7-dimethoxy-3,4-dihydro-1H-isochromen-1-yl)methyl]-4-pyridin-2-ylpiperazine Traditional Name: 1-[(6,7-dimethoxyisochroman-1-yl)methyl]-4-(2-pyridyl)piperazine Formula: C21H27N3O3 MolecularWeight: 369.45738

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(OCCC2=C1)CN3CCN(CC3)C4=CC=CC=N4)OC

Isomeric SMILES

COC1=C(C=C2C(OCCC2=C1)CN3CCN(CC3)C4=CC=CC=N4)OC

InChI

InChI=1S/C21H27N3O3/c1-25-18-13-16-6-12-27-20(17(16)14-19(18)26-2)15-23-8-10-24(11-9-23)21-5-3-4-7-22-21/h3-5,7,13-14,20H,6,8-12,15H2,1-2H3