3-ethynyl-N-[1-(2-fluoranyl-4-methoxy-phenyl)ethyl]aniline

Systemtic Name: 3-ethynyl-N-[1-(2-fluoranyl-4-methoxy-phenyl)ethyl]aniline Openeye Name: 3-ethynyl-N-[1-(2-fluoro-4-methoxy-phenyl)ethyl]aniline CAS Name: 3-ethynyl-N-[1-(2-fluoro-4-methoxyphenyl)ethyl]aniline IUPAC Name: 3-ethynyl-N-[1-(2-fluoro-4-methoxyphenyl)ethyl]aniline Traditional Name: (3-ethynylphenyl)-[1-(2-fluoro-4-methoxy-phenyl)ethyl]amine Formula: C17H16FNO MolecularWeight: 269.313443

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C(C=C1)OC)F)NC2=CC=CC(=C2)C#C

Isomeric SMILES

CC(C1=C(C=C(C=C1)OC)F)NC2=CC=CC(=C2)C#C

InChI

InChI=1S/C17H16FNO/c1-4-13-6-5-7-14(10-13)19-12(2)16-9-8-15(20-3)11-17(16)18/h1,5-12,19H,2-3H3