1-tert-butyl-2-isocyanato-3,4-dimethyl-benzene

Systemtic Name: 1-tert-butyl-2-isocyanato-3,4-dimethyl-benzene Openeye Name: 1-tert-butyl-2-isocyanato-3,4-dimethyl-benzene CAS Name: 1-tert-butyl-2-isocyanato-3,4-dimethylbenzene IUPAC Name: 1-tert-butyl-2-isocyanato-3,4-dimethylbenzene Traditional Name: 1-tert-butyl-2-isocyanato-3,4-dimethyl-benzene Formula: C13H17NO MolecularWeight: 203.28018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C(C)(C)C)N=C=O)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C(C)(C)C)N=C=O)C

InChI

InChI=1S/C13H17NO/c1-9-6-7-11(13(3,4)5)12(10(9)2)14-8-15/h6-7H,1-5H3