(4-isocyanato-2,6-dimethyl-phenyl) ethanoate

Systemtic Name: (4-isocyanato-2,6-dimethyl-phenyl) ethanoate Openeye Name: (4-isocyanato-2,6-dimethyl-phenyl) acetate CAS Name: acetic acid (4-isocyanato-2,6-dimethylphenyl) ester IUPAC Name: (4-isocyanato-2,6-dimethylphenyl) acetate Traditional Name: acetic acid (4-isocyanato-2,6-dimethyl-phenyl) ester Formula: C11H11NO3 MolecularWeight: 205.20994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC(=O)C)C)N=C=O

Isomeric SMILES

CC1=CC(=CC(=C1OC(=O)C)C)N=C=O

InChI

InChI=1S/C11H11NO3/c1-7-4-10(12-6-13)5-8(2)11(7)15-9(3)14/h4-5H,1-3H3