2-acetamidoethyl-[(1S)-1-(3-chloranyl-4-fluoranyl-phenyl)ethyl]azanium

Systemtic Name: 2-acetamidoethyl-[(1S)-1-(3-chloranyl-4-fluoranyl-phenyl)ethyl]azanium Openeye Name: 2-acetamidoethyl-[(1S)-1-(3-chloro-4-fluoro-phenyl)ethyl]ammonium CAS Name: 2-acetamidoethyl-[(1S)-1-(3-chloro-4-fluorophenyl)ethyl]ammonium IUPAC Name: 2-acetamidoethyl-[(1S)-1-(3-chloro-4-fluorophenyl)ethyl]azanium Traditional Name: 2-acetamidoethyl-[(1S)-1-(3-chloro-4-fluoro-phenyl)ethyl]ammonium Formula: C12H17ClFN2O+ MolecularWeight: 259.727583

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)F)Cl)[NH2+]CCNC(=O)C

Isomeric SMILES

C[C@@H](C1=CC(=C(C=C1)F)Cl)[NH2+]CCNC(=O)C

InChI

InChI=1S/C12H16ClFN2O/c1-8(15-5-6-16-9(2)17)10-3-4-12(14)11(13)7-10/h3-4,7-8,15H,5-6H2,1-2H3,(H,16,17)/p+1/t8-/m0/s1