4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-3-fluoranyl-N'-oxidanyl-benzenecarboximidamide

Systemtic Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-3-fluoranyl-N'-oxidanyl-benzenecarboximidamide Openeye Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-3-fluoro-N'-hydroxy-benzamidine CAS Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-3-fluoro-N'-hydroxybenzenecarboximidamide IUPAC Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-3-fluoro-N'-hydroxybenzenecarboximidamide Traditional Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-3-fluoro-N'-hydroxy-benzamidine Formula: C17H18FN3O MolecularWeight: 299.342723

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CC3=C(C=C(C=C3)C(=NO)N)F

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CC3=C(C=C(C=C3)/C(=N/O)/N)F

InChI

InChI=1S/C17H18FN3O/c18-16-9-13(17(19)20-22)5-6-15(16)11-21-8-7-12-3-1-2-4-14(12)10-21/h1-6,9,22H,7-8,10-11H2,(H2,19,20)