methyl 3-(4-isocyanophenyl)-2-methyl-propanoate

Systemtic Name: methyl 3-(4-isocyanophenyl)-2-methyl-propanoate Openeye Name: methyl 3-(4-isocyanophenyl)-2-methyl-propanoate CAS Name: 3-(4-isocyanophenyl)-2-methylpropanoic acid methyl ester IUPAC Name: methyl 3-(4-isocyanophenyl)-2-methylpropanoate Traditional Name: 3-(4-isocyanophenyl)-2-methyl-propionic acid methyl ester Formula: C12H13NO2 MolecularWeight: 203.23712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=C(C=C1)[N+]#[C-])C(=O)OC

Isomeric SMILES

CC(CC1=CC=C(C=C1)[N+]#[C-])C(=O)OC

InChI

InChI=1S/C12H13NO2/c1-9(12(14)15-3)8-10-4-6-11(13-2)7-5-10/h4-7,9H,8H2,1,3H3