ethyl (E)-2-isocyano-3-phenyl-hex-4-enoate

Systemtic Name: ethyl (E)-2-isocyano-3-phenyl-hex-4-enoate Openeye Name: ethyl (E)-2-isocyano-3-phenyl-hex-4-enoate CAS Name: (E)-2-isocyano-3-phenyl-4-hexenoic acid ethyl ester IUPAC Name: ethyl (E)-2-isocyano-3-phenylhex-4-enoate Traditional Name: (E)-2-isocyano-3-phenyl-hex-4-enoic acid ethyl ester Formula: C15H17NO2 MolecularWeight: 243.30098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C=CC)C1=CC=CC=C1)[N+]#[C-]

Isomeric SMILES

CCOC(=O)C(C(/C=C/C)C1=CC=CC=C1)[N+]#[C-]

InChI

InChI=1S/C15H17NO2/c1-4-9-13(12-10-7-6-8-11-12)14(16-3)15(17)18-5-2/h4,6-11,13-14H,5H2,1-2H3/b9-4+