(2S)-2-[[(2S)-2-(4-ethanoylpiperazin-1-yl)propanoyl]amino]-4-methyl-pentanoic acid

Systemtic Name: (2S)-2-[[(2S)-2-(4-ethanoylpiperazin-1-yl)propanoyl]amino]-4-methyl-pentanoic acid Openeye Name: (2S)-2-[[(2S)-2-(4-acetylpiperazin-1-yl)propanoyl]amino]-4-methyl-pentanoic acid CAS Name: (2S)-2-[[(2S)-2-(4-acetyl-1-piperazinyl)-1-oxopropyl]amino]-4-methylpentanoic acid IUPAC Name: (2S)-2-[[(2S)-2-(4-acetylpiperazin-1-yl)propanoyl]amino]-4-methylpentanoic acid Traditional Name: (2S)-2-[[(2S)-2-(4-acetylpiperazino)propanoyl]amino]-4-methyl-valeric acid Formula: C15H27N3O4 MolecularWeight: 313.39258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)C(C)N1CCN(CC1)C(=O)C

Isomeric SMILES

C[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)O)N1CCN(CC1)C(=O)C

InChI

InChI=1S/C15H27N3O4/c1-10(2)9-13(15(21)22)16-14(20)11(3)17-5-7-18(8-6-17)12(4)19/h10-11,13H,5-9H2,1-4H3,(H,16,20)(H,21,22)/t11-,13-/m0/s1