3-[[(2S)-2-phenylbutanoyl]amino]propylazanium

Systemtic Name: 3-[[(2S)-2-phenylbutanoyl]amino]propylazanium Openeye Name: 3-[[(2S)-2-phenylbutanoyl]amino]propylammonium CAS Name: 3-[[(2S)-1-oxo-2-phenylbutyl]amino]propylammonium IUPAC Name: 3-[[(2S)-2-phenylbutanoyl]amino]propylazanium Traditional Name: 3-[[(2S)-2-phenylbutanoyl]amino]propylammonium Formula: C13H21N2O+ MolecularWeight: 221.31864

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)NCCC[NH3+]

Isomeric SMILES

CC[C@@H](C1=CC=CC=C1)C(=O)NCCC[NH3+]

InChI

InChI=1S/C13H20N2O/c1-2-12(11-7-4-3-5-8-11)13(16)15-10-6-9-14/h3-5,7-8,12H,2,6,9-10,14H2,1H3,(H,15,16)/p+1/t12-/m0/s1