(E)-4-methyl-4-oxidanyl-3-(2-oxidanylidene-1,3-benzoxazol-3-yl)pent-2-enenitrile

Systemtic Name: (E)-4-methyl-4-oxidanyl-3-(2-oxidanylidene-1,3-benzoxazol-3-yl)pent-2-enenitrile Openeye Name: (E)-4-hydroxy-4-methyl-3-(2-oxo-1,3-benzoxazol-3-yl)pent-2-enenitrile CAS Name: (E)-4-hydroxy-4-methyl-3-(2-oxo-1,3-benzoxazol-3-yl)-2-pentenenitrile IUPAC Name: (E)-4-hydroxy-4-methyl-3-(2-oxo-1,3-benzoxazol-3-yl)pent-2-enenitrile Traditional Name: (E)-4-hydroxy-3-(2-keto-1,3-benzoxazol-3-yl)-4-methyl-pent-2-enenitrile Formula: C13H12N2O3 MolecularWeight: 244.24598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=CC#N)N1C2=CC=CC=C2OC1=O)O

Isomeric SMILES

CC(C)(/C(=C\C#N)/N1C2=CC=CC=C2OC1=O)O

InChI

InChI=1S/C13H12N2O3/c1-13(2,17)11(7-8-14)15-9-5-3-4-6-10(9)18-12(15)16/h3-7,17H,1-2H3/b11-7+