3-[2-[(5S,7S)-3-(2-cyanoethoxymethyl)-1-adamantyl]ethoxy]propanenitrile

Systemtic Name: 3-[2-[(5S,7S)-3-(2-cyanoethoxymethyl)-1-adamantyl]ethoxy]propanenitrile Openeye Name: 3-[2-[(5S,7S)-3-(2-cyanoethoxymethyl)-1-adamantyl]ethoxy]propanenitrile CAS Name: 3-[2-[(5S,7S)-3-(2-cyanoethoxymethyl)-1-adamantyl]ethoxy]propanenitrile IUPAC Name: 3-[2-[(5S,7S)-3-(2-cyanoethoxymethyl)-1-adamantyl]ethoxy]propanenitrile Traditional Name: 3-[2-[(5S,7S)-3-(2-cyanoethoxymethyl)-1-adamantyl]ethoxy]propionitrile Formula: C19H28N2O2 MolecularWeight: 316.43782

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)COCCC#N)CCOCCC#N

Isomeric SMILES

C1[C@H]2CC3(C[C@H]1CC(C2)(C3)COCCC#N)CCOCCC#N

InChI

InChI=1S/C19H28N2O2/c20-4-1-6-22-8-3-18-10-16-9-17(11-18)13-19(12-16,14-18)15-23-7-2-5-21/h16-17H,1-3,6-15H2/t16-,17-,18?,19?/m0/s1