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

Systemtic Name: 1-[(6,7-dimethoxy-3,4-dihydro-1H-isochromen-1-yl)methyl]-4-(phenylmethyl)piperazine Openeye Name: 1-benzyl-4-[(6,7-dimethoxyisochroman-1-yl)methyl]piperazine CAS Name: 1-[(6,7-dimethoxy-3,4-dihydro-1H-2-benzopyran-1-yl)methyl]-4-(phenylmethyl)piperazine IUPAC Name: 1-benzyl-4-[(6,7-dimethoxy-3,4-dihydro-1H-isochromen-1-yl)methyl]piperazine Traditional Name: 1-benzyl-4-[(6,7-dimethoxyisochroman-1-yl)methyl]piperazine Formula: C23H30N2O3 MolecularWeight: 382.4959

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(OCCC2=C1)CN3CCN(CC3)CC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2C(OCCC2=C1)CN3CCN(CC3)CC4=CC=CC=C4)OC

InChI

InChI=1S/C23H30N2O3/c1-26-21-14-19-8-13-28-23(20(19)15-22(21)27-2)17-25-11-9-24(10-12-25)16-18-6-4-3-5-7-18/h3-7,14-15,23H,8-13,16-17H2,1-2H3