5-fluoranyl-2-[(6-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-N-(4-phenylbutyl)benzamide

Systemtic Name: 5-fluoranyl-2-[(6-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-N-(4-phenylbutyl)benzamide Openeye Name: 5-fluoro-2-[(6-hydroxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-N-(4-phenylbutyl)benzamide CAS Name: 5-fluoro-2-[(6-hydroxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-N-(4-phenylbutyl)benzamide IUPAC Name: 5-fluoro-2-[(6-hydroxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-N-(4-phenylbutyl)benzamide Traditional Name: 5-fluoro-2-[(6-hydroxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-N-(4-phenylbutyl)benzamide Formula: C27H29FN2O2 MolecularWeight: 432.529763

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=C(C=C2)O)CC3=C(C=C(C=C3)F)C(=O)NCCCCC4=CC=CC=C4

Isomeric SMILES

C1CN(CC2=C1C=C(C=C2)O)CC3=C(C=C(C=C3)F)C(=O)NCCCCC4=CC=CC=C4

InChI

InChI=1S/C27H29FN2O2/c28-24-11-9-23(19-30-15-13-21-16-25(31)12-10-22(21)18-30)26(17-24)27(32)29-14-5-4-8-20-6-2-1-3-7-20/h1-3,6-7,9-12,16-17,31H,4-5,8,13-15,18-19H2,(H,29,32)