7-isocyanato-3,3-dimethyl-1,2-dihydroindene

Systemtic Name: 7-isocyanato-3,3-dimethyl-1,2-dihydroindene Openeye Name: 4-isocyanato-1,1-dimethyl-indane CAS Name: 7-isocyanato-3,3-dimethyl-1,2-dihydroindene IUPAC Name: 7-isocyanato-3,3-dimethyl-1,2-dihydroindene Traditional Name: 4-isocyanato-1,1-dimethyl-indane Formula: C12H13NO MolecularWeight: 187.23772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC2=C1C=CC=C2N=C=O)C

Isomeric SMILES

CC1(CCC2=C1C=CC=C2N=C=O)C

InChI

InChI=1S/C12H13NO/c1-12(2)7-6-9-10(12)4-3-5-11(9)13-8-14/h3-5H,6-7H2,1-2H3