N-[(2S)-2-cyano-3-methyl-butan-2-yl]-2-[4-(3-cyclopentylpropanoyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[(2S)-2-cyano-3-methyl-butan-2-yl]-2-[4-(3-cyclopentylpropanoyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-[(1S)-1-cyano-1,2-dimethyl-propyl]-2-[4-(3-cyclopentylpropanoyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[(2S)-2-cyano-3-methylbutan-2-yl]-2-[4-(3-cyclopentyl-1-oxopropyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[(2S)-2-cyano-3-methylbutan-2-yl]-2-[4-(3-cyclopentylpropanoyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-[(1S)-1-cyano-1,2-dimethyl-propyl]-2-[4-(3-cyclopentylpropanoyl)piperazin-1-ium-1-yl]acetamide Formula: C20H35N4O2+ MolecularWeight: 363.5175

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C#N)NC(=O)C[NH+]1CCN(CC1)C(=O)CCC2CCCC2

Isomeric SMILES

CC(C)[C@@](C)(C#N)NC(=O)C[NH+]1CCN(CC1)C(=O)CCC2CCCC2

InChI

InChI=1S/C20H34N4O2/c1-16(2)20(3,15-21)22-18(25)14-23-10-12-24(13-11-23)19(26)9-8-17-6-4-5-7-17/h16-17H,4-14H2,1-3H3,(H,22,25)/p+1/t20-/m1/s1