3-[4-(3,4-dihydro-1H-isochromen-1-ylmethyl)piperazin-1-yl]-1-(2-methylphenyl)propan-1-one

Systemtic Name: 3-[4-(3,4-dihydro-1H-isochromen-1-ylmethyl)piperazin-1-yl]-1-(2-methylphenyl)propan-1-one Openeye Name: 3-[4-(isochroman-1-ylmethyl)piperazin-1-yl]-1-(o-tolyl)propan-1-one CAS Name: 3-[4-(3,4-dihydro-1H-2-benzopyran-1-ylmethyl)-1-piperazinyl]-1-(2-methylphenyl)-1-propanone IUPAC Name: 3-[4-(3,4-dihydro-1H-isochromen-1-ylmethyl)piperazin-1-yl]-1-(2-methylphenyl)propan-1-one Traditional Name: 3-[4-(isochroman-1-ylmethyl)piperazino]-1-(o-tolyl)propan-1-one Formula: C24H30N2O2 MolecularWeight: 378.5072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)CCN2CCN(CC2)CC3C4=CC=CC=C4CCO3

Isomeric SMILES

CC1=CC=CC=C1C(=O)CCN2CCN(CC2)CC3C4=CC=CC=C4CCO3

InChI

InChI=1S/C24H30N2O2/c1-19-6-2-4-8-21(19)23(27)10-12-25-13-15-26(16-14-25)18-24-22-9-5-3-7-20(22)11-17-28-24/h2-9,24H,10-18H2,1H3