5-(1-adamantylamino)-2,2-diphenyl-pentanenitrile

Systemtic Name: 5-(1-adamantylamino)-2,2-diphenyl-pentanenitrile Openeye Name: 5-(1-adamantylamino)-2,2-diphenyl-pentanenitrile CAS Name: 5-(1-adamantylamino)-2,2-diphenylpentanenitrile IUPAC Name: 5-(1-adamantylamino)-2,2-diphenylpentanenitrile Traditional Name: 5-(1-adamantylamino)-2,2-diphenyl-valeronitrile Formula: C27H32N2 MolecularWeight: 384.55638

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NCCCC(C#N)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NCCCC(C#N)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H32N2/c28-20-27(24-8-3-1-4-9-24,25-10-5-2-6-11-25)12-7-13-29-26-17-21-14-22(18-26)16-23(15-21)19-26/h1-6,8-11,21-23,29H,7,12-19H2