2-chloranylpropane; 2-phenylethanenitrile

Systemtic Name: 2-chloranylpropane; 2-phenylethanenitrile Openeye Name: 2-chloropropane; 2-phenylacetonitrile CAS Name: 2-chloropropane; 2-phenylacetonitrile IUPAC Name: 2-chloropropane; 2-phenylacetonitrile Traditional Name: 2-chloropropane; 2-phenylacetonitrile Formula: C11H14ClN MolecularWeight: 195.68856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)Cl.C1=CC=C(C=C1)CC#N

Isomeric SMILES

CC(C)Cl.C1=CC=C(C=C1)CC#N

InChI

InChI=1S/C8H7N.C3H7Cl/c9-7-6-8-4-2-1-3-5-8;1-3(2)4/h1-5H,6H2;3H,1-2H3