(2S)-2-bromanyl-N,N-bis(cyanomethyl)-3-methyl-butanamide

Systemtic Name: (2S)-2-bromanyl-N,N-bis(cyanomethyl)-3-methyl-butanamide Openeye Name: (2S)-2-bromo-N,N-bis(cyanomethyl)-3-methyl-butanamide CAS Name: (2S)-2-bromo-N,N-bis(cyanomethyl)-3-methylbutanamide IUPAC Name: (2S)-2-bromo-N,N-bis(cyanomethyl)-3-methylbutanamide Traditional Name: (2S)-2-bromo-N,N-bis(cyanomethyl)-3-methyl-butyramide Formula: C9H12BrN3O MolecularWeight: 258.11508

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H12BrN3O/c1-7(2)8(10)9(14)13(5-3-11)6-4-12/h7-8H,5-6H2,1-2H3/t8-/m0/s1