(2S)-2-[[2,2-dimethyl-3-(4-methylpiperazin-1-yl)propanoyl]amino]-3-methyl-butanoic acid

Systemtic Name: (2S)-2-[[2,2-dimethyl-3-(4-methylpiperazin-1-yl)propanoyl]amino]-3-methyl-butanoic acid Openeye Name: (2S)-2-[[2,2-dimethyl-3-(4-methylpiperazin-1-yl)propanoyl]amino]-3-methyl-butanoic acid CAS Name: (2S)-2-[[2,2-dimethyl-3-(4-methyl-1-piperazinyl)-1-oxopropyl]amino]-3-methylbutanoic acid IUPAC Name: (2S)-2-[[2,2-dimethyl-3-(4-methylpiperazin-1-yl)propanoyl]amino]-3-methylbutanoic acid Traditional Name: (2S)-2-[[2,2-dimethyl-3-(4-methylpiperazino)propanoyl]amino]-3-methyl-butyric acid Formula: C15H29N3O3 MolecularWeight: 299.40906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)C(C)(C)CN1CCN(CC1)C

Isomeric SMILES

CC(C)[C@@H](C(=O)O)NC(=O)C(C)(C)CN1CCN(CC1)C

InChI

InChI=1S/C15H29N3O3/c1-11(2)12(13(19)20)16-14(21)15(3,4)10-18-8-6-17(5)7-9-18/h11-12H,6-10H2,1-5H3,(H,16,21)(H,19,20)/t12-/m0/s1