N-[[3-fluoranyl-4-(4-propan-2-ylphenoxy)phenyl]methyl]ethanamine

Systemtic Name: N-[[3-fluoranyl-4-(4-propan-2-ylphenoxy)phenyl]methyl]ethanamine Openeye Name: N-[[3-fluoro-4-(4-isopropylphenoxy)phenyl]methyl]ethanamine CAS Name: N-[[3-fluoro-4-(4-propan-2-ylphenoxy)phenyl]methyl]ethanamine IUPAC Name: N-[[3-fluoro-4-(4-propan-2-ylphenoxy)phenyl]methyl]ethanamine Traditional Name: ethyl-[3-fluoro-4-(4-isopropylphenoxy)benzyl]amine Formula: C18H22FNO MolecularWeight: 287.371783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNCC1=CC(=C(C=C1)OC2=CC=C(C=C2)C(C)C)F

Isomeric SMILES

CCNCC1=CC(=C(C=C1)OC2=CC=C(C=C2)C(C)C)F

InChI

InChI=1S/C18H22FNO/c1-4-20-12-14-5-10-18(17(19)11-14)21-16-8-6-15(7-9-16)13(2)3/h5-11,13,20H,4,12H2,1-3H3