1-(isocyanatomethyl)-2,3-dimethyl-4-prop-1-en-2-yl-benzene

Systemtic Name: 1-(isocyanatomethyl)-2,3-dimethyl-4-prop-1-en-2-yl-benzene Openeye Name: 1-(isocyanatomethyl)-4-isopropenyl-2,3-dimethyl-benzene CAS Name: 1-(isocyanatomethyl)-2,3-dimethyl-4-(1-methylethenyl)benzene IUPAC Name: 1-(isocyanatomethyl)-2,3-dimethyl-4-prop-1-en-2-ylbenzene Traditional Name: 1-(isocyanatomethyl)-4-isopropenyl-2,3-dimethyl-benzene Formula: C13H15NO MolecularWeight: 201.2643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C)C(=C)C)CN=C=O

Isomeric SMILES

CC1=C(C=CC(=C1C)C(=C)C)CN=C=O

InChI

InChI=1S/C13H15NO/c1-9(2)13-6-5-12(7-14-8-15)10(3)11(13)4/h5-6H,1,7H2,2-4H3