5-(3-methylbutyl)-3-phenyl-1,3,4-oxadiazol-2-one

Systemtic Name: 5-(3-methylbutyl)-3-phenyl-1,3,4-oxadiazol-2-one Openeye Name: 5-isopentyl-3-phenyl-1,3,4-oxadiazol-2-one CAS Name: 5-(3-methylbutyl)-3-phenyl-1,3,4-oxadiazol-2-one IUPAC Name: 5-(3-methylbutyl)-3-phenyl-1,3,4-oxadiazol-2-one Traditional Name: 5-isoamyl-3-phenyl-1,3,4-oxadiazol-2-one Formula: C13H16N2O2 MolecularWeight: 232.27834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1=NN(C(=O)O1)C2=CC=CC=C2

Isomeric SMILES

CC(C)CCC1=NN(C(=O)O1)C2=CC=CC=C2

InChI

InChI=1S/C13H16N2O2/c1-10(2)8-9-12-14-15(13(16)17-12)11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3