(2S)-1-[3-(4-ethanoylpiperazin-1-yl)-2,2-dimethyl-propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-[3-(4-ethanoylpiperazin-1-yl)-2,2-dimethyl-propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-[3-(4-acetylpiperazin-1-yl)-2,2-dimethyl-propanoyl]pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[3-(4-acetyl-1-piperazinyl)-2,2-dimethyl-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-[3-(4-acetylpiperazin-1-yl)-2,2-dimethylpropanoyl]pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-[3-(4-acetylpiperazino)-2,2-dimethyl-propanoyl]proline Formula: C16H27N3O4 MolecularWeight: 325.40328

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)CC(C)(C)C(=O)N2CCCC2C(=O)O

Isomeric SMILES

CC(=O)N1CCN(CC1)CC(C)(C)C(=O)N2CCC[C@H]2C(=O)O

InChI

InChI=1S/C16H27N3O4/c1-12(20)18-9-7-17(8-10-18)11-16(2,3)15(23)19-6-4-5-13(19)14(21)22/h13H,4-11H2,1-3H3,(H,21,22)/t13-/m0/s1