2-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]-oxidanyl-methylidene]propanedinitrile

Systemtic Name: 2-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]-oxidanyl-methylidene]propanedinitrile Openeye Name: 2-[[3-(2-chlorophenyl)-5-methyl-isoxazol-4-yl]-hydroxy-methylene]propanedinitrile CAS Name: 2-[[3-(2-chlorophenyl)-5-methyl-4-isoxazolyl]-hydroxymethylidene]propanedinitrile IUPAC Name: 2-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]-hydroxymethylidene]propanedinitrile Traditional Name: 2-[[3-(2-chlorophenyl)-5-methyl-isoxazol-4-yl]-hydroxy-methylene]malononitrile Formula: C14H8ClN3O2 MolecularWeight: 285.68522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=C(C#N)C#N)O

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=C(C#N)C#N)O

InChI

InChI=1S/C14H8ClN3O2/c1-8-12(14(19)9(6-16)7-17)13(18-20-8)10-4-2-3-5-11(10)15/h2-5,19H,1H3