(2S)-N,N-bis(cyanomethyl)-2-ethyl-hexanamide

Systemtic Name: (2S)-N,N-bis(cyanomethyl)-2-ethyl-hexanamide Openeye Name: (2S)-N,N-bis(cyanomethyl)-2-ethyl-hexanamide CAS Name: (2S)-N,N-bis(cyanomethyl)-2-ethylhexanamide IUPAC Name: (2S)-N,N-bis(cyanomethyl)-2-ethylhexanamide Traditional Name: (2S)-N,N-bis(cyanomethyl)-2-ethyl-hexanamide Formula: C12H19N3O MolecularWeight: 221.29876

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)N(CC#N)CC#N

Isomeric SMILES

CCCC[C@H](CC)C(=O)N(CC#N)CC#N

InChI

InChI=1S/C12H19N3O/c1-3-5-6-11(4-2)12(16)15(9-7-13)10-8-14/h11H,3-6,9-10H2,1-2H3/t11-/m0/s1