[(2S)-3-methyl-1-oxidanylidene-1-[(2-oxidanylidene-2-phenylazanyl-ethyl)amino]butan-2-yl]azanium

Systemtic Name: [(2S)-3-methyl-1-oxidanylidene-1-[(2-oxidanylidene-2-phenylazanyl-ethyl)amino]butan-2-yl]azanium Openeye Name: [(1S)-1-[(2-anilino-2-oxo-ethyl)carbamoyl]-2-methyl-propyl]ammonium CAS Name: [(2S)-1-[(2-anilino-2-oxoethyl)amino]-3-methyl-1-oxobutan-2-yl]ammonium IUPAC Name: [(2S)-1-[(2-anilino-2-oxoethyl)amino]-3-methyl-1-oxobutan-2-yl]azanium Traditional Name: [(1S)-1-[(2-anilino-2-keto-ethyl)carbamoyl]-2-methyl-propyl]ammonium Formula: C13H20N3O2+ MolecularWeight: 250.3168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC(=O)NC1=CC=CC=C1)[NH3+]

Isomeric SMILES

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

InChI

InChI=1S/C13H19N3O2/c1-9(2)12(14)13(18)15-8-11(17)16-10-6-4-3-5-7-10/h3-7,9,12H,8,14H2,1-2H3,(H,15,18)(H,16,17)/p+1/t12-/m0/s1