(2S)-2-acetamido-6-azanyl-N-methyl-hexanamide hydrate

Systemtic Name: (2S)-2-acetamido-6-azanyl-N-methyl-hexanamide hydrate Openeye Name: (2S)-2-acetamido-6-amino-N-methyl-hexanamide hydrate CAS Name: (2S)-2-acetamido-6-amino-N-methylhexanamide hydrate IUPAC Name: (2S)-2-acetamido-6-amino-N-methylhexanamide hydrate Traditional Name: (2S)-2-acetamido-6-amino-N-methyl-hexanamide hydrate Formula: C9H21N3O3 MolecularWeight: 219.28134

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H19N3O2.H2O/c1-7(13)12-8(9(14)11-2)5-3-4-6-10;/h8H,3-6,10H2,1-2H3,(H,11,14)(H,12,13);1H2/t8-;/m0./s1