3-fluoranyl-4-[[(2S)-4-methylpentan-2-yl]oxymethyl]benzenecarboximidamide

Systemtic Name: 3-fluoranyl-4-[[(2S)-4-methylpentan-2-yl]oxymethyl]benzenecarboximidamide Openeye Name: 4-[[(1S)-1,3-dimethylbutoxy]methyl]-3-fluoro-benzamidine CAS Name: 3-fluoro-4-[[(2S)-4-methylpentan-2-yl]oxymethyl]benzenecarboximidamide IUPAC Name: 3-fluoro-4-[[(2S)-4-methylpentan-2-yl]oxymethyl]benzenecarboximidamide Traditional Name: 4-[[(1S)-1,3-dimethylbutoxy]methyl]-3-fluoro-benzamidine Formula: C14H21FN2O MolecularWeight: 252.327743

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C)OCC1=C(C=C(C=C1)C(=N)N)F

Isomeric SMILES

C[C@@H](CC(C)C)OCC1=C(C=C(C=C1)C(=N)N)F

InChI

InChI=1S/C14H21FN2O/c1-9(2)6-10(3)18-8-12-5-4-11(14(16)17)7-13(12)15/h4-5,7,9-10H,6,8H2,1-3H3,(H3,16,17)/t10-/m0/s1