[2-[[2-[[(2S)-butan-2-yl]carbamoyl]phenyl]amino]-2-oxidanylidene-ethyl]azanium

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC=CC=C1NC(=O)C[NH3+]

Isomeric SMILES

CC[C@H](C)NC(=O)C1=CC=CC=C1NC(=O)C[NH3+]

InChI

InChI=1S/C13H19N3O2/c1-3-9(2)15-13(18)10-6-4-5-7-11(10)16-12(17)8-14/h4-7,9H,3,8,14H2,1-2H3,(H,15,18)(H,16,17)/p+1/t9-/m0/s1