(2S)-2-[[(2S)-2-(azepan-1-yl)propanoyl]amino]propanoic acid

Systemtic Name: (2S)-2-[[(2S)-2-(azepan-1-yl)propanoyl]amino]propanoic acid Openeye Name: (2S)-2-[[(2S)-2-(azepan-1-yl)propanoyl]amino]propanoic acid CAS Name: (2S)-2-[[(2S)-2-(1-azepanyl)-1-oxopropyl]amino]propanoic acid IUPAC Name: (2S)-2-[[(2S)-2-(azepan-1-yl)propanoyl]amino]propanoic acid Traditional Name: (2S)-2-[[(2S)-2-(azepan-1-yl)propanoyl]amino]propionic acid Formula: C12H22N2O3 MolecularWeight: 242.31468

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)C(C)N1CCCCCC1

Isomeric SMILES

C[C@@H](C(=O)O)NC(=O)[C@H](C)N1CCCCCC1

InChI

InChI=1S/C12H22N2O3/c1-9(12(16)17)13-11(15)10(2)14-7-5-3-4-6-8-14/h9-10H,3-8H2,1-2H3,(H,13,15)(H,16,17)/t9-,10-/m0/s1