1-(2-isocyanatopropan-2-yl)-2-methyl-3-prop-1-en-2-yl-benzene

Systemtic Name: 1-(2-isocyanatopropan-2-yl)-2-methyl-3-prop-1-en-2-yl-benzene Openeye Name: 1-(1-isocyanato-1-methyl-ethyl)-3-isopropenyl-2-methyl-benzene CAS Name: 1-(2-isocyanatopropan-2-yl)-2-methyl-3-(1-methylethenyl)benzene IUPAC Name: 1-(2-isocyanatopropan-2-yl)-2-methyl-3-prop-1-en-2-ylbenzene Traditional Name: 1-(1-isocyanato-1-methyl-ethyl)-3-isopropenyl-2-methyl-benzene Formula: C14H17NO MolecularWeight: 215.29088

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17NO/c1-10(2)12-7-6-8-13(11(12)3)14(4,5)15-9-16/h6-8H,1H2,2-5H3