3-(3,5,7-triphenyl-1-adamantyl)propanenitrile

Systemtic Name: 3-(3,5,7-triphenyl-1-adamantyl)propanenitrile Openeye Name: 3-(3,5,7-triphenyl-1-adamantyl)propanenitrile CAS Name: 3-(3,5,7-triphenyl-1-adamantyl)propanenitrile IUPAC Name: 3-(3,5,7-triphenyl-1-adamantyl)propanenitrile Traditional Name: 3-(3,5,7-triphenyl-1-adamantyl)propionitrile Formula: C31H31N MolecularWeight: 417.58454

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Descriptors Computed from Structure

Canonical SMILES:

C1C2(CC3(CC1(CC(C2)(C3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6)CCC#N

Isomeric SMILES

C1C2(CC3(CC1(CC(C2)(C3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6)CCC#N

InChI

InChI=1S/C31H31N/c32-18-10-17-28-19-29(25-11-4-1-5-12-25)22-30(20-28,26-13-6-2-7-14-26)24-31(21-28,23-29)27-15-8-3-9-16-27/h1-9,11-16H,10,17,19-24H2