3-[(1-oxidanylbutan-2-ylamino)methyl]benzenecarbonitrile

Systemtic Name: 3-[(1-oxidanylbutan-2-ylamino)methyl]benzenecarbonitrile Openeye Name: 3-[[1-(hydroxymethyl)propylamino]methyl]benzonitrile CAS Name: 3-[(1-hydroxybutan-2-ylamino)methyl]benzonitrile IUPAC Name: 3-[(1-hydroxybutan-2-ylamino)methyl]benzonitrile Traditional Name: 3-[(1-methylolpropylamino)methyl]benzonitrile Formula: C12H16N2O MolecularWeight: 204.26824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NCC1=CC=CC(=C1)C#N

Isomeric SMILES

CCC(CO)NCC1=CC=CC(=C1)C#N

InChI

InChI=1S/C12H16N2O/c1-2-12(9-15)14-8-11-5-3-4-10(6-11)7-13/h3-6,12,14-15H,2,8-9H2,1H3