N-[[4-(1,3-benzodioxol-5-yloxy)-3-fluoranyl-phenyl]methyl]ethanamine

Systemtic Name: N-[[4-(1,3-benzodioxol-5-yloxy)-3-fluoranyl-phenyl]methyl]ethanamine Openeye Name: N-[[4-(1,3-benzodioxol-5-yloxy)-3-fluoro-phenyl]methyl]ethanamine CAS Name: N-[[4-(1,3-benzodioxol-5-yloxy)-3-fluorophenyl]methyl]ethanamine IUPAC Name: N-[[4-(1,3-benzodioxol-5-yloxy)-3-fluorophenyl]methyl]ethanamine Traditional Name: [4-(1,3-benzodioxol-5-yloxy)-3-fluoro-benzyl]-ethyl-amine Formula: C16H16FNO3 MolecularWeight: 289.301543

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC1=CC(=C(C=C1)OC2=CC3=C(C=C2)OCO3)F

Isomeric SMILES

CCNCC1=CC(=C(C=C1)OC2=CC3=C(C=C2)OCO3)F

InChI

InChI=1S/C16H16FNO3/c1-2-18-9-11-3-5-14(13(17)7-11)21-12-4-6-15-16(8-12)20-10-19-15/h3-8,18H,2,9-10H2,1H3