2-(1-isocyanoethyl)-1-methoxy-4-octyl-benzene

Systemtic Name: 2-(1-isocyanoethyl)-1-methoxy-4-octyl-benzene Openeye Name: 2-(1-isocyanoethyl)-1-methoxy-4-octyl-benzene CAS Name: 2-(1-isocyanoethyl)-1-methoxy-4-octylbenzene IUPAC Name: 2-(1-isocyanoethyl)-1-methoxy-4-octylbenzene Traditional Name: 2-(1-isocyanoethyl)-1-methoxy-4-octyl-benzene Formula: C18H27NO MolecularWeight: 273.41308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC(=C(C=C1)OC)C(C)[N+]#[C-]

Isomeric SMILES

CCCCCCCCC1=CC(=C(C=C1)OC)C(C)[N+]#[C-]

InChI

InChI=1S/C18H27NO/c1-5-6-7-8-9-10-11-16-12-13-18(20-4)17(14-16)15(2)19-3/h12-15H,5-11H2,1-2,4H3