1-(2-isocyanato-3-methyl-butan-2-yl)-2-methyl-benzene

Systemtic Name: 1-(2-isocyanato-3-methyl-butan-2-yl)-2-methyl-benzene Openeye Name: 1-(1-isocyanato-1,2-dimethyl-propyl)-2-methyl-benzene CAS Name: 1-(2-isocyanato-3-methylbutan-2-yl)-2-methylbenzene IUPAC Name: 1-(2-isocyanato-3-methylbutan-2-yl)-2-methylbenzene Traditional Name: 1-(1-isocyanato-1,2-dimethyl-propyl)-2-methyl-benzene Formula: C13H17NO MolecularWeight: 203.28018

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO/c1-10(2)13(4,14-9-15)12-8-6-5-7-11(12)3/h5-8,10H,1-4H3