(phenylmethyl)-[(1S)-2,2,2-tris(chloranyl)-1-(2,2-dimethylpropanoylamino)ethyl]azanium

Systemtic Name: (phenylmethyl)-[(1S)-2,2,2-tris(chloranyl)-1-(2,2-dimethylpropanoylamino)ethyl]azanium Openeye Name: benzyl-[(1S)-2,2,2-trichloro-1-(2,2-dimethylpropanoylamino)ethyl]ammonium CAS Name: (phenylmethyl)-[(1S)-2,2,2-trichloro-1-[(2,2-dimethyl-1-oxopropyl)amino]ethyl]ammonium IUPAC Name: benzyl-[(1S)-2,2,2-trichloro-1-(2,2-dimethylpropanoylamino)ethyl]azanium Traditional Name: benzyl-[(1S)-2,2,2-trichloro-1-(pivaloylamino)ethyl]ammonium Formula: C14H20Cl3N2O+ MolecularWeight: 338.6804

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(C)C(=O)N[C@H](C(Cl)(Cl)Cl)[NH2+]CC1=CC=CC=C1

InChI

InChI=1S/C14H19Cl3N2O/c1-13(2,3)12(20)19-11(14(15,16)17)18-9-10-7-5-4-6-8-10/h4-8,11,18H,9H2,1-3H3,(H,19,20)/p+1/t11-/m1/s1