1-isocyanato-2,3-di(propan-2-yl)benzene

Systemtic Name: 1-isocyanato-2,3-di(propan-2-yl)benzene Openeye Name: 1-isocyanato-2,3-diisopropyl-benzene CAS Name: 1-isocyanato-2,3-di(propan-2-yl)benzene IUPAC Name: 1-isocyanato-2,3-di(propan-2-yl)benzene Traditional Name: 1-isocyanato-2,3-diisopropyl-benzene Formula: C13H17NO MolecularWeight: 203.28018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)N=C=O)C(C)C

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)N=C=O)C(C)C

InChI

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