2-[(1R,3S)-5-phenyl-2-adamantyl]propanedinitrile

Systemtic Name: 2-[(1R,3S)-5-phenyl-2-adamantyl]propanedinitrile Openeye Name: 2-[(1R,3S)-5-phenyl-2-adamantyl]propanedinitrile CAS Name: 2-[(1R,3S)-5-phenyl-2-adamantyl]propanedinitrile IUPAC Name: 2-[(1R,3S)-5-phenyl-2-adamantyl]propanedinitrile Traditional Name: 2-[(1R,3S)-5-phenyl-2-adamantyl]malononitrile Formula: C19H20N2 MolecularWeight: 276.3755

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC(C2)(CC1C3C(C#N)C#N)C4=CC=CC=C4

Isomeric SMILES

C1[C@@H]2CC3(C[C@@H](C2C(C#N)C#N)CC1C3)C4=CC=CC=C4

InChI

InChI=1S/C19H20N2/c20-11-16(12-21)18-14-6-13-7-15(18)10-19(8-13,9-14)17-4-2-1-3-5-17/h1-5,13-16,18H,6-10H2/t13?,14-,15+,18?,19?