[2-[[(2S)-2-cyano-3-methyl-butan-2-yl]amino]-2-oxidanylidene-ethyl]-ethyl-(phenylmethyl)azanium

Systemtic Name: [2-[[(2S)-2-cyano-3-methyl-butan-2-yl]amino]-2-oxidanylidene-ethyl]-ethyl-(phenylmethyl)azanium Openeye Name: benzyl-[2-[[(1S)-1-cyano-1,2-dimethyl-propyl]amino]-2-oxo-ethyl]-ethyl-ammonium CAS Name: [2-[[(2S)-2-cyano-3-methylbutan-2-yl]amino]-2-oxoethyl]-ethyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[2-[[(2S)-2-cyano-3-methylbutan-2-yl]amino]-2-oxoethyl]-ethylazanium Traditional Name: benzyl-[2-[[(1S)-1-cyano-1,2-dimethyl-propyl]amino]-2-keto-ethyl]-ethyl-ammonium Formula: C17H26N3O+ MolecularWeight: 288.40784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=CC=C1)CC(=O)NC(C)(C#N)C(C)C

Isomeric SMILES

CC[NH+](CC1=CC=CC=C1)CC(=O)N[C@](C)(C#N)C(C)C

InChI

InChI=1S/C17H25N3O/c1-5-20(11-15-9-7-6-8-10-15)12-16(21)19-17(4,13-18)14(2)3/h6-10,14H,5,11-12H2,1-4H3,(H,19,21)/p+1/t17-/m1/s1