(2S)-2-acetamido-6-azanyl-hexanoic acid hydrate

Systemtic Name: (2S)-2-acetamido-6-azanyl-hexanoic acid hydrate Openeye Name: (2S)-2-acetamido-6-amino-hexanoic acid hydrate CAS Name: (2S)-2-acetamido-6-aminohexanoic acid hydrate IUPAC Name: (2S)-2-acetamido-6-aminohexanoic acid hydrate Traditional Name: (2S)-2-acetamido-6-amino-hexanoic acid hydrate Formula: C8H18N2O4 MolecularWeight: 206.23952

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCCCN)C(=O)O.O

Isomeric SMILES

CC(=O)N[C@@H](CCCCN)C(=O)O.O

InChI

InChI=1S/C8H16N2O3.H2O/c1-6(11)10-7(8(12)13)4-2-3-5-9;/h7H,2-5,9H2,1H3,(H,10,11)(H,12,13);1H2/t7-;/m0./s1