2-[4-[(4-oxidanylbutylamino)methyl]phenyl]benzenecarbonitrile

Systemtic Name: 2-[4-[(4-oxidanylbutylamino)methyl]phenyl]benzenecarbonitrile Openeye Name: 2-[4-[(4-hydroxybutylamino)methyl]phenyl]benzonitrile CAS Name: 2-[4-[(4-hydroxybutylamino)methyl]phenyl]benzonitrile IUPAC Name: 2-[4-[(4-hydroxybutylamino)methyl]phenyl]benzonitrile Traditional Name: 2-[4-[(4-hydroxybutylamino)methyl]phenyl]benzonitrile Formula: C18H20N2O MolecularWeight: 280.3642

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)C2=CC=C(C=C2)CNCCCCO

Isomeric SMILES

C1=CC=C(C(=C1)C#N)C2=CC=C(C=C2)CNCCCCO

InChI

InChI=1S/C18H20N2O/c19-13-17-5-1-2-6-18(17)16-9-7-15(8-10-16)14-20-11-3-4-12-21/h1-2,5-10,20-21H,3-4,11-12,14H2