2-[3-(2-isocyanatopropan-2-yl)phenyl]propan-2-ylcarbamic acid; tungsten

Systemtic Name: 2-[3-(2-isocyanatopropan-2-yl)phenyl]propan-2-ylcarbamic acid; tungsten Openeye Name: [1-[3-(1-isocyanato-1-methyl-ethyl)phenyl]-1-methyl-ethyl]carbamic acid; tungsten CAS Name: 2-[3-(2-isocyanatopropan-2-yl)phenyl]propan-2-ylcarbamic acid; tungsten IUPAC Name: 2-[3-(2-isocyanatopropan-2-yl)phenyl]propan-2-ylcarbamic acid; tungsten Traditional Name: [1-[3-(1-isocyanato-1-methyl-ethyl)phenyl]-1-methyl-ethyl]carbamic acid; tungsten Formula: C28H36N4O6W MolecularWeight: 708.44864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC(=CC=C1)C(C)(C)NC(=O)O)N=C=O.CC(C)(C1=CC(=CC=C1)C(C)(C)NC(=O)O)N=C=O.[W]

Isomeric SMILES

CC(C)(C1=CC(=CC=C1)C(C)(C)NC(=O)O)N=C=O.CC(C)(C1=CC(=CC=C1)C(C)(C)NC(=O)O)N=C=O.[W]

InChI

InChI=1S/2C14H18N2O3.W/c2*1-13(2,15-9-17)10-6-5-7-11(8-10)14(3,4)16-12(18)19;/h2*5-8,16H,1-4H3,(H,18,19);