4-[(1-adamantylamino)methyl]benzenecarbonitrile

Systemtic Name: 4-[(1-adamantylamino)methyl]benzenecarbonitrile Openeye Name: 4-[(1-adamantylamino)methyl]benzonitrile CAS Name: 4-[(1-adamantylamino)methyl]benzonitrile IUPAC Name: 4-[(1-adamantylamino)methyl]benzonitrile Traditional Name: 4-[(1-adamantylamino)methyl]benzonitrile Formula: C18H22N2 MolecularWeight: 266.38068

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NCC4=CC=C(C=C4)C#N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NCC4=CC=C(C=C4)C#N

InChI

InChI=1S/C18H22N2/c19-11-13-1-3-14(4-2-13)12-20-18-8-15-5-16(9-18)7-17(6-15)10-18/h1-4,15-17,20H,5-10,12H2