(4E)-3-tert-butyl-4-[(1-prop-2-enylpyrrol-2-yl)methylidene]-1,2-oxazol-5-one

Systemtic Name: (4E)-3-tert-butyl-4-[(1-prop-2-enylpyrrol-2-yl)methylidene]-1,2-oxazol-5-one Openeye Name: (4E)-4-[(1-allylpyrrol-2-yl)methylene]-3-tert-butyl-isoxazol-5-one CAS Name: (4E)-3-tert-butyl-4-[(1-prop-2-enyl-2-pyrrolyl)methylidene]-5-isoxazolone IUPAC Name: (4E)-3-tert-butyl-4-[(1-prop-2-enylpyrrol-2-yl)methylidene]-1,2-oxazol-5-one Traditional Name: (4E)-4-[(1-allylpyrrol-2-yl)methylene]-3-tert-butyl-2-isoxazolin-5-one Formula: C15H18N2O2 MolecularWeight: 258.31562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NOC(=O)C1=CC2=CC=CN2CC=C

Isomeric SMILES

CC(C)(C)C\1=NOC(=O)/C1=C/C2=CC=CN2CC=C

InChI

InChI=1S/C15H18N2O2/c1-5-8-17-9-6-7-11(17)10-12-13(15(2,3)4)16-19-14(12)18/h5-7,9-10H,1,8H2,2-4H3/b12-10+