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

Systemtic Name: 3-[1-(1-oxidanylbutan-2-ylamino)ethyl]benzenecarbonitrile Openeye Name: 3-[1-[1-(hydroxymethyl)propylamino]ethyl]benzonitrile CAS Name: 3-[1-(1-hydroxybutan-2-ylamino)ethyl]benzonitrile IUPAC Name: 3-[1-(1-hydroxybutan-2-ylamino)ethyl]benzonitrile Traditional Name: 3-[1-(1-methylolpropylamino)ethyl]benzonitrile Formula: C13H18N2O MolecularWeight: 218.29482

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O/c1-3-13(9-16)15-10(2)12-6-4-5-11(7-12)8-14/h4-7,10,13,15-16H,3,9H2,1-2H3