ethyl 3-(3-isocyano-4-oxidanyl-phenyl)propanoate

Systemtic Name: ethyl 3-(3-isocyano-4-oxidanyl-phenyl)propanoate Openeye Name: ethyl 3-(4-hydroxy-3-isocyano-phenyl)propanoate CAS Name: 3-(4-hydroxy-3-isocyanophenyl)propanoic acid ethyl ester IUPAC Name: ethyl 3-(4-hydroxy-3-isocyanophenyl)propanoate Traditional Name: 3-(4-hydroxy-3-isocyano-phenyl)propionic acid ethyl ester Formula: C12H13NO3 MolecularWeight: 219.23652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=CC(=C(C=C1)O)[N+]#[C-]

Isomeric SMILES

CCOC(=O)CCC1=CC(=C(C=C1)O)[N+]#[C-]

InChI

InChI=1S/C12H13NO3/c1-3-16-12(15)7-5-9-4-6-11(14)10(8-9)13-2/h4,6,8,14H,3,5,7H2,1H3