isocyanatobenzene; 1-isocyanatobutane

Systemtic Name: isocyanatobenzene; 1-isocyanatobutane Openeye Name: isocyanatobenzene; 1-isocyanatobutane CAS Name: isocyanatobenzene; 1-isocyanatobutane IUPAC Name: isocyanatobenzene; 1-isocyanatobutane Traditional Name: isocyanatobenzene; 1-isocyanatobutane Formula: C12H14N2O2 MolecularWeight: 218.25176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H5NO.C5H9NO/c9-6-8-7-4-2-1-3-5-7;1-2-3-4-6-5-7/h1-5H;2-4H2,1H3