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

Systemtic Name: 3-[4-(3,4-dihydro-1H-isochromen-1-ylmethyl)piperazin-1-yl]-1-phenyl-propan-1-one Openeye Name: 3-[4-(isochroman-1-ylmethyl)piperazin-1-yl]-1-phenyl-propan-1-one CAS Name: 3-[4-(3,4-dihydro-1H-2-benzopyran-1-ylmethyl)-1-piperazinyl]-1-phenyl-1-propanone IUPAC Name: 3-[4-(3,4-dihydro-1H-isochromen-1-ylmethyl)piperazin-1-yl]-1-phenylpropan-1-one Traditional Name: 3-[4-(isochroman-1-ylmethyl)piperazino]-1-phenyl-propan-1-one Formula: C23H28N2O2 MolecularWeight: 364.48062

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(C2=CC=CC=C21)CN3CCN(CC3)CCC(=O)C4=CC=CC=C4

Isomeric SMILES

C1COC(C2=CC=CC=C21)CN3CCN(CC3)CCC(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H28N2O2/c26-22(20-7-2-1-3-8-20)10-12-24-13-15-25(16-14-24)18-23-21-9-5-4-6-19(21)11-17-27-23/h1-9,23H,10-18H2