[(2S,3S)-3-methyl-1-oxidanylidene-1-(3-phenylpropylamino)pentan-2-yl]azanium

Systemtic Name: [(2S,3S)-3-methyl-1-oxidanylidene-1-(3-phenylpropylamino)pentan-2-yl]azanium Openeye Name: [(1S,2S)-2-methyl-1-(3-phenylpropylcarbamoyl)butyl]ammonium CAS Name: [(2S,3S)-3-methyl-1-oxo-1-(3-phenylpropylamino)pentan-2-yl]ammonium IUPAC Name: [(2S,3S)-3-methyl-1-oxo-1-(3-phenylpropylamino)pentan-2-yl]azanium Traditional Name: [(1S,2S)-2-methyl-1-(3-phenylpropylcarbamoyl)butyl]ammonium Formula: C15H25N2O+ MolecularWeight: 249.3718

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NCCCC1=CC=CC=C1)[NH3+]

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)NCCCC1=CC=CC=C1)[NH3+]

InChI

InChI=1S/C15H24N2O/c1-3-12(2)14(16)15(18)17-11-7-10-13-8-5-4-6-9-13/h4-6,8-9,12,14H,3,7,10-11,16H2,1-2H3,(H,17,18)/p+1/t12-,14-/m0/s1