1-[4-[3-(4-fluoranylphenoxy)phenyl]but-3-yn-2-yl]urea

Systemtic Name: 1-[4-[3-(4-fluoranylphenoxy)phenyl]but-3-yn-2-yl]urea Openeye Name: [3-[3-(4-fluorophenoxy)phenyl]-1-methyl-prop-2-ynyl]urea CAS Name: 4-[3-(4-fluorophenoxy)phenyl]but-3-yn-2-ylurea IUPAC Name: 4-[3-(4-fluorophenoxy)phenyl]but-3-yn-2-ylurea Traditional Name: [3-[3-(4-fluorophenoxy)phenyl]-1-methyl-prop-2-ynyl]urea Formula: C17H15FN2O2 MolecularWeight: 298.311603

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#CC1=CC(=CC=C1)OC2=CC=C(C=C2)F)NC(=O)N

Isomeric SMILES

CC(C#CC1=CC(=CC=C1)OC2=CC=C(C=C2)F)NC(=O)N

InChI

InChI=1S/C17H15FN2O2/c1-12(20-17(19)21)5-6-13-3-2-4-16(11-13)22-15-9-7-14(18)8-10-15/h2-4,7-12H,1H3,(H3,19,20,21)