4-[1-(prop-2-ynylamino)ethyl]benzenecarbonitrile

Systemtic Name: 4-[1-(prop-2-ynylamino)ethyl]benzenecarbonitrile Openeye Name: 4-[1-(prop-2-ynylamino)ethyl]benzonitrile CAS Name: 4-[1-(prop-2-ynylamino)ethyl]benzonitrile IUPAC Name: 4-[1-(prop-2-ynylamino)ethyl]benzonitrile Traditional Name: 4-[1-(propargylamino)ethyl]benzonitrile Formula: C12H12N2 MolecularWeight: 184.23708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C#N)NCC#C

Isomeric SMILES

CC(C1=CC=C(C=C1)C#N)NCC#C

InChI

InChI=1S/C12H12N2/c1-3-8-14-10(2)12-6-4-11(9-13)5-7-12/h1,4-7,10,14H,8H2,2H3