(2S)-2-[3-(4-ethanoylpiperazin-1-yl)propanoylamino]-4-methyl-pentanoic acid

Systemtic Name: (2S)-2-[3-(4-ethanoylpiperazin-1-yl)propanoylamino]-4-methyl-pentanoic acid Openeye Name: (2S)-2-[3-(4-acetylpiperazin-1-yl)propanoylamino]-4-methyl-pentanoic acid CAS Name: (2S)-2-[[3-(4-acetyl-1-piperazinyl)-1-oxopropyl]amino]-4-methylpentanoic acid IUPAC Name: (2S)-2-[3-(4-acetylpiperazin-1-yl)propanoylamino]-4-methylpentanoic acid Traditional Name: (2S)-2-[3-(4-acetylpiperazino)propanoylamino]-4-methyl-valeric acid Formula: C15H27N3O4 MolecularWeight: 313.39258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)CCN1CCN(CC1)C(=O)C

Isomeric SMILES

CC(C)C[C@@H](C(=O)O)NC(=O)CCN1CCN(CC1)C(=O)C

InChI

InChI=1S/C15H27N3O4/c1-11(2)10-13(15(21)22)16-14(20)4-5-17-6-8-18(9-7-17)12(3)19/h11,13H,4-10H2,1-3H3,(H,16,20)(H,21,22)/t13-/m0/s1