1-(isocyanatomethyl)-2-(2-methylbutan-2-yl)benzene

Systemtic Name: 1-(isocyanatomethyl)-2-(2-methylbutan-2-yl)benzene Openeye Name: 1-(1,1-dimethylpropyl)-2-(isocyanatomethyl)benzene CAS Name: 1-(isocyanatomethyl)-2-(2-methylbutan-2-yl)benzene IUPAC Name: 1-(isocyanatomethyl)-2-(2-methylbutan-2-yl)benzene Traditional Name: 1-tert-amyl-2-(isocyanatomethyl)benzene Formula: C13H17NO MolecularWeight: 203.28018

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=CC=C1CN=C=O

Isomeric SMILES

CCC(C)(C)C1=CC=CC=C1CN=C=O

InChI

InChI=1S/C13H17NO/c1-4-13(2,3)12-8-6-5-7-11(12)9-14-10-15/h5-8H,4,9H2,1-3H3