4-[(2S,3R)-3-methyl-4-methylidene-5-oxidanylidene-oxolan-2-yl]benzenecarbonitrile

Systemtic Name: 4-[(2S,3R)-3-methyl-4-methylidene-5-oxidanylidene-oxolan-2-yl]benzenecarbonitrile Openeye Name: 4-[(2S,3R)-3-methyl-4-methylene-5-oxo-tetrahydrofuran-2-yl]benzonitrile CAS Name: 4-[(2S,3R)-3-methyl-4-methylene-5-oxo-2-oxolanyl]benzonitrile IUPAC Name: 4-[(2S,3R)-3-methyl-4-methylidene-5-oxooxolan-2-yl]benzonitrile Traditional Name: 4-[(2S,3R)-5-keto-3-methyl-4-methylene-tetrahydrofuran-2-yl]benzonitrile Formula: C13H11NO2 MolecularWeight: 213.23194

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(OC(=O)C1=C)C2=CC=C(C=C2)C#N

Isomeric SMILES

C[C@H]1[C@H](OC(=O)C1=C)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C13H11NO2/c1-8-9(2)13(15)16-12(8)11-5-3-10(7-14)4-6-11/h3-6,8,12H,2H2,1H3/t8-,12+/m1/s1