1-[(1-oxidanyl-1-oxidanylidene-octan-2-yl)-(1-oxidanyl-1-oxidanylidene-propan-2-yl)amino]piperazine-2-carboxylic acid

Systemtic Name: 1-[(1-oxidanyl-1-oxidanylidene-octan-2-yl)-(1-oxidanyl-1-oxidanylidene-propan-2-yl)amino]piperazine-2-carboxylic acid Openeye Name: 1-[1-carboxyheptyl-(2-hydroxy-1-methyl-2-oxo-ethyl)amino]piperazine-2-carboxylic acid CAS Name: 1-[(1-hydroxy-1-oxooctan-2-yl)-(1-hydroxy-1-oxopropan-2-yl)amino]-2-piperazinecarboxylic acid IUPAC Name: 1-[(1-hydroxy-1-oxooctan-2-yl)-(1-hydroxy-1-oxopropan-2-yl)amino]piperazine-2-carboxylic acid Traditional Name: 1-[1-carboxyheptyl-(2-hydroxy-2-keto-1-methyl-ethyl)amino]piperazine-2-carboxylic acid Formula: C16H29N3O6 MolecularWeight: 359.41796

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)O)N(C(C)C(=O)O)N1CCNCC1C(=O)O

Isomeric SMILES

CCCCCCC(C(=O)O)N(C(C)C(=O)O)N1CCNCC1C(=O)O

InChI

InChI=1S/C16H29N3O6/c1-3-4-5-6-7-12(15(22)23)19(11(2)14(20)21)18-9-8-17-10-13(18)16(24)25/h11-13,17H,3-10H2,1-2H3,(H,20,21)(H,22,23)(H,24,25)