4-(5-methyl-3-phenyl-1,4,2-dioxazol-5-yl)pentan-2-one

Systemtic Name: 4-(5-methyl-3-phenyl-1,4,2-dioxazol-5-yl)pentan-2-one Openeye Name: 4-(5-methyl-3-phenyl-1,4,2-dioxazol-5-yl)pentan-2-one CAS Name: 4-(5-methyl-3-phenyl-1,4,2-dioxazol-5-yl)-2-pentanone IUPAC Name: 4-(5-methyl-3-phenyl-1,4,2-dioxazol-5-yl)pentan-2-one Traditional Name: 4-(5-methyl-3-phenyl-1,4,2-dioxazol-5-yl)pentan-2-one Formula: C14H17NO3 MolecularWeight: 247.28968

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)C)C1(OC(=NO1)C2=CC=CC=C2)C

Isomeric SMILES

CC(CC(=O)C)C1(OC(=NO1)C2=CC=CC=C2)C

InChI

InChI=1S/C14H17NO3/c1-10(9-11(2)16)14(3)17-13(15-18-14)12-7-5-4-6-8-12/h4-8,10H,9H2,1-3H3