2-(isocyanatomethyl)-1,3,5-trimethyl-benzene

Systemtic Name: 2-(isocyanatomethyl)-1,3,5-trimethyl-benzene Openeye Name: 2-(isocyanatomethyl)-1,3,5-trimethyl-benzene CAS Name: 2-(isocyanatomethyl)-1,3,5-trimethylbenzene IUPAC Name: 2-(isocyanatomethyl)-1,3,5-trimethylbenzene Traditional Name: 2-(isocyanatomethyl)-1,3,5-trimethyl-benzene Formula: C11H13NO MolecularWeight: 175.22702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)CN=C=O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)CN=C=O)C

InChI

InChI=1S/C11H13NO/c1-8-4-9(2)11(6-12-7-13)10(3)5-8/h4-5H,6H2,1-3H3