[(2S)-1-oxidanylidene-1-(pentan-3-ylamino)propan-2-yl]-(phenylmethyl)azanium

Systemtic Name: [(2S)-1-oxidanylidene-1-(pentan-3-ylamino)propan-2-yl]-(phenylmethyl)azanium Openeye Name: benzyl-[(1S)-2-(1-ethylpropylamino)-1-methyl-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-oxo-1-(pentan-3-ylamino)propan-2-yl]-(phenylmethyl)ammonium IUPAC Name: benzyl-[(2S)-1-oxo-1-(pentan-3-ylamino)propan-2-yl]azanium Traditional Name: benzyl-[(1S)-2-(1-ethylpropylamino)-2-keto-1-methyl-ethyl]ammonium Formula: C15H25N2O+ MolecularWeight: 249.3718

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)C(C)[NH2+]CC1=CC=CC=C1

Isomeric SMILES

CCC(CC)NC(=O)[C@H](C)[NH2+]CC1=CC=CC=C1

InChI

InChI=1S/C15H24N2O/c1-4-14(5-2)17-15(18)12(3)16-11-13-9-7-6-8-10-13/h6-10,12,14,16H,4-5,11H2,1-3H3,(H,17,18)/p+1/t12-/m0/s1