2-[[3-[(1-cyanopropylamino)methyl]phenyl]methylamino]butanenitrile

Systemtic Name: 2-[[3-[(1-cyanopropylamino)methyl]phenyl]methylamino]butanenitrile Openeye Name: 2-[[3-[(1-cyanopropylamino)methyl]phenyl]methylamino]butanenitrile CAS Name: 2-[[3-[(1-cyanopropylamino)methyl]phenyl]methylamino]butanenitrile IUPAC Name: 2-[[3-[(1-cyanopropylamino)methyl]phenyl]methylamino]butanenitrile Traditional Name: 2-[[3-[(1-cyanopropylamino)methyl]benzyl]amino]butyronitrile Formula: C16H22N4 MolecularWeight: 270.37268

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N4/c1-3-15(9-17)19-11-13-6-5-7-14(8-13)12-20-16(4-2)10-18/h5-8,15-16,19-20H,3-4,11-12H2,1-2H3