4-(2-isocyanatopropan-2-yl)-1,2-dimethyl-benzene

Systemtic Name: 4-(2-isocyanatopropan-2-yl)-1,2-dimethyl-benzene Openeye Name: 4-(1-isocyanato-1-methyl-ethyl)-1,2-dimethyl-benzene CAS Name: 4-(2-isocyanatopropan-2-yl)-1,2-dimethylbenzene IUPAC Name: 4-(2-isocyanatopropan-2-yl)-1,2-dimethylbenzene Traditional Name: 4-(1-isocyanato-1-methyl-ethyl)-1,2-dimethyl-benzene Formula: C12H15NO MolecularWeight: 189.2536

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO/c1-9-5-6-11(7-10(9)2)12(3,4)13-8-14/h5-7H,1-4H3