3-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-3-oxidanylidene-propanenitrile

Systemtic Name: 3-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-3-oxidanylidene-propanenitrile Openeye Name: 3-(5-methyl-3-phenyl-isoxazol-4-yl)-3-oxo-propanenitrile CAS Name: 3-(5-methyl-3-phenyl-4-isoxazolyl)-3-oxopropanenitrile IUPAC Name: 3-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-3-oxopropanenitrile Traditional Name: 3-keto-3-(5-methyl-3-phenyl-isoxazol-4-yl)propionitrile Formula: C13H10N2O2 MolecularWeight: 226.2307

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)CC#N

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)CC#N

InChI

InChI=1S/C13H10N2O2/c1-9-12(11(16)7-8-14)13(15-17-9)10-5-3-2-4-6-10/h2-6H,7H2,1H3