4-phenyl-5-propyl-1,2-oxazol-3-one

Systemtic Name: 4-phenyl-5-propyl-1,2-oxazol-3-one Openeye Name: 4-phenyl-5-propyl-isoxazol-3-one CAS Name: 4-phenyl-5-propyl-3-isoxazolone IUPAC Name: 4-phenyl-5-propyl-1,2-oxazol-3-one Traditional Name: 4-phenyl-5-propyl-4-isoxazolin-3-one Formula: C12H13NO2 MolecularWeight: 203.23712

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=O)NO1)C2=CC=CC=C2

Isomeric SMILES

CCCC1=C(C(=O)NO1)C2=CC=CC=C2

InChI

InChI=1S/C12H13NO2/c1-2-6-10-11(12(14)13-15-10)9-7-4-3-5-8-9/h3-5,7-8H,2,6H2,1H3,(H,13,14)