1-[3-azanyl-4-(2-ethynylphenoxy)phenyl]ethanone

Systemtic Name: 1-[3-azanyl-4-(2-ethynylphenoxy)phenyl]ethanone Openeye Name: 1-[3-amino-4-(2-ethynylphenoxy)phenyl]ethanone CAS Name: 1-[3-amino-4-(2-ethynylphenoxy)phenyl]ethanone IUPAC Name: 1-[3-amino-4-(2-ethynylphenoxy)phenyl]ethanone Traditional Name: 1-[3-amino-4-(2-ethynylphenoxy)phenyl]ethanone Formula: C16H13NO2 MolecularWeight: 251.27992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC2=CC=CC=C2C#C)N

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC2=CC=CC=C2C#C)N

InChI

InChI=1S/C16H13NO2/c1-3-12-6-4-5-7-15(12)19-16-9-8-13(11(2)18)10-14(16)17/h1,4-10H,17H2,2H3