2-isocyanato-1,3,5-trimethyl-4-prop-1-en-2-yl-benzene

Systemtic Name: 2-isocyanato-1,3,5-trimethyl-4-prop-1-en-2-yl-benzene Openeye Name: 2-isocyanato-4-isopropenyl-1,3,5-trimethyl-benzene CAS Name: 2-isocyanato-1,3,5-trimethyl-4-(1-methylethenyl)benzene IUPAC Name: 2-isocyanato-1,3,5-trimethyl-4-prop-1-en-2-ylbenzene Traditional Name: 2-isocyanato-4-isopropenyl-1,3,5-trimethyl-benzene Formula: C13H15NO MolecularWeight: 201.2643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO/c1-8(2)12-9(3)6-10(4)13(11(12)5)14-7-15/h6H,1H2,2-5H3