(2S)-2-azanyl-5-(4-butan-2-ylpiperazin-1-yl)-5-oxidanylidene-pentanoic acid

Systemtic Name: (2S)-2-azanyl-5-(4-butan-2-ylpiperazin-1-yl)-5-oxidanylidene-pentanoic acid Openeye Name: (2S)-2-amino-5-oxo-5-(4-sec-butylpiperazin-1-yl)pentanoic acid CAS Name: (2S)-2-amino-5-(4-butan-2-yl-1-piperazinyl)-5-oxopentanoic acid IUPAC Name: (2S)-2-amino-5-(4-butan-2-ylpiperazin-1-yl)-5-oxopentanoic acid Traditional Name: (2S)-2-amino-5-keto-5-(4-sec-butylpiperazino)valeric acid Formula: C13H25N3O3 MolecularWeight: 271.3559

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1CCN(CC1)C(=O)CCC(C(=O)O)N

Isomeric SMILES

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

InChI

InChI=1S/C13H25N3O3/c1-3-10(2)15-6-8-16(9-7-15)12(17)5-4-11(14)13(18)19/h10-11H,3-9,14H2,1-2H3,(H,18,19)/t10?,11-/m0/s1