[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenyl]-[4-(2-fluorophenyl)piperazin-1-yl]methanone

Systemtic Name: [4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenyl]-[4-(2-fluorophenyl)piperazin-1-yl]methanone Openeye Name: [4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenyl]-[4-(2-fluorophenyl)piperazin-1-yl]methanone CAS Name: [4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenyl]-[4-(2-fluorophenyl)-1-piperazinyl]methanone IUPAC Name: [4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenyl]-[4-(2-fluorophenyl)piperazin-1-yl]methanone Traditional Name: [4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenyl]-[4-(2-fluorophenyl)piperazino]methanone Formula: C27H28FN3O MolecularWeight: 429.529123

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CC3=CC=C(C=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5F

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CC3=CC=C(C=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5F

InChI

InChI=1S/C27H28FN3O/c28-25-7-3-4-8-26(25)30-15-17-31(18-16-30)27(32)23-11-9-21(10-12-23)19-29-14-13-22-5-1-2-6-24(22)20-29/h1-12H,13-20H2