[(1S)-1-[2-(pentanoylamino)phenyl]ethyl]azanium

Systemtic Name: [(1S)-1-[2-(pentanoylamino)phenyl]ethyl]azanium Openeye Name: [(1S)-1-[2-(pentanoylamino)phenyl]ethyl]ammonium CAS Name: [(1S)-1-[2-(1-oxopentylamino)phenyl]ethyl]ammonium IUPAC Name: [(1S)-1-[2-(pentanoylamino)phenyl]ethyl]azanium Traditional Name: [(1S)-1-[2-(valerylamino)phenyl]ethyl]ammonium Formula: C13H21N2O+ MolecularWeight: 221.31864

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC=CC=C1C(C)[NH3+]

Isomeric SMILES

CCCCC(=O)NC1=CC=CC=C1[C@H](C)[NH3+]

InChI

InChI=1S/C13H20N2O/c1-3-4-9-13(16)15-12-8-6-5-7-11(12)10(2)14/h5-8,10H,3-4,9,14H2,1-2H3,(H,15,16)/p+1/t10-/m0/s1