2-[3-(aminomethyl)-2,4,6-trimethyl-phenyl]ethanenitrile

Systemtic Name: 2-[3-(aminomethyl)-2,4,6-trimethyl-phenyl]ethanenitrile Openeye Name: 2-[3-(aminomethyl)-2,4,6-trimethyl-phenyl]acetonitrile CAS Name: 2-[3-(aminomethyl)-2,4,6-trimethylphenyl]acetonitrile IUPAC Name: 2-[3-(aminomethyl)-2,4,6-trimethylphenyl]acetonitrile Traditional Name: 2-[3-(aminomethyl)-2,4,6-trimethyl-phenyl]acetonitrile Formula: C12H16N2 MolecularWeight: 188.26884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1CC#N)C)CN)C

Isomeric SMILES

CC1=CC(=C(C(=C1CC#N)C)CN)C

InChI

InChI=1S/C12H16N2/c1-8-6-9(2)12(7-14)10(3)11(8)4-5-13/h6H,4,7,14H2,1-3H3