[(3S)-3-isocyanato-4-methyl-pent-1-en-2-yl]benzene

Systemtic Name: [(3S)-3-isocyanato-4-methyl-pent-1-en-2-yl]benzene Openeye Name: [(2S)-2-isocyanato-3-methyl-1-methylene-butyl]benzene CAS Name: [(3S)-3-isocyanato-4-methylpent-1-en-2-yl]benzene IUPAC Name: [(3S)-3-isocyanato-4-methylpent-1-en-2-yl]benzene Traditional Name: 1-[(1S)-1-isocyanato-2-methyl-propyl]vinylbenzene Formula: C13H15NO MolecularWeight: 201.2643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)[C@@H](C(=C)C1=CC=CC=C1)N=C=O

InChI

InChI=1S/C13H15NO/c1-10(2)13(14-9-15)11(3)12-7-5-4-6-8-12/h4-8,10,13H,3H2,1-2H3/t13-/m0/s1