2-ethenyl-1-(4-isocyanatobutyl)-3-methyl-benzene

Systemtic Name: 2-ethenyl-1-(4-isocyanatobutyl)-3-methyl-benzene Openeye Name: 1-(4-isocyanatobutyl)-3-methyl-2-vinyl-benzene CAS Name: 2-ethenyl-1-(4-isocyanatobutyl)-3-methylbenzene IUPAC Name: 2-ethenyl-1-(4-isocyanatobutyl)-3-methylbenzene Traditional Name: 1-(4-isocyanatobutyl)-3-methyl-2-vinyl-benzene Formula: C14H17NO MolecularWeight: 215.29088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)CCCCN=C=O)C=C

Isomeric SMILES

CC1=C(C(=CC=C1)CCCCN=C=O)C=C

InChI

InChI=1S/C14H17NO/c1-3-14-12(2)7-6-9-13(14)8-4-5-10-15-11-16/h3,6-7,9H,1,4-5,8,10H2,2H3