prop-2-enyl-[(1S)-2,2,2-tris(chloranyl)-1-(2-phenylethanoylamino)ethyl]azanium

Systemtic Name: prop-2-enyl-[(1S)-2,2,2-tris(chloranyl)-1-(2-phenylethanoylamino)ethyl]azanium Openeye Name: allyl-[(1S)-2,2,2-trichloro-1-[(2-phenylacetyl)amino]ethyl]ammonium CAS Name: prop-2-enyl-[(1S)-2,2,2-trichloro-1-[(1-oxo-2-phenylethyl)amino]ethyl]ammonium IUPAC Name: prop-2-enyl-[(1S)-2,2,2-trichloro-1-[(2-phenylacetyl)amino]ethyl]azanium Traditional Name: allyl-[(1S)-2,2,2-trichloro-1-[(2-phenylacetyl)amino]ethyl]ammonium Formula: C13H16Cl3N2O+ MolecularWeight: 322.63794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15Cl3N2O/c1-2-8-17-12(13(14,15)16)18-11(19)9-10-6-4-3-5-7-10/h2-7,12,17H,1,8-9H2,(H,18,19)/p+1/t12-/m1/s1