(2S)-2-azanyl-5-[4-(2-cyanoethyl)piperazin-1-yl]-5-oxidanylidene-pentanoic acid

Systemtic Name: (2S)-2-azanyl-5-[4-(2-cyanoethyl)piperazin-1-yl]-5-oxidanylidene-pentanoic acid Openeye Name: (2S)-2-amino-5-[4-(2-cyanoethyl)piperazin-1-yl]-5-oxo-pentanoic acid CAS Name: (2S)-2-amino-5-[4-(2-cyanoethyl)-1-piperazinyl]-5-oxopentanoic acid IUPAC Name: (2S)-2-amino-5-[4-(2-cyanoethyl)piperazin-1-yl]-5-oxopentanoic acid Traditional Name: (2S)-2-amino-5-[4-(2-cyanoethyl)piperazino]-5-keto-valeric acid Formula: C12H20N4O3 MolecularWeight: 268.3122

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC#N)C(=O)CCC(C(=O)O)N

Isomeric SMILES

C1CN(CCN1CCC#N)C(=O)CC[C@@H](C(=O)O)N

InChI

InChI=1S/C12H20N4O3/c13-4-1-5-15-6-8-16(9-7-15)11(17)3-2-10(14)12(18)19/h10H,1-3,5-9,14H2,(H,18,19)/t10-/m0/s1