[2-[(2-chloranyl-6-fluoranyl-phenyl)methyl-propan-2-yl-amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: [2-[(2-chloranyl-6-fluoranyl-phenyl)methyl-propan-2-yl-amino]-2-oxidanylidene-ethyl]azanium Openeye Name: [2-[(2-chloro-6-fluoro-phenyl)methyl-isopropyl-amino]-2-oxo-ethyl]ammonium CAS Name: [2-[(2-chloro-6-fluorophenyl)methyl-propan-2-ylamino]-2-oxoethyl]ammonium IUPAC Name: [2-[(2-chloro-6-fluorophenyl)methyl-propan-2-ylamino]-2-oxoethyl]azanium Traditional Name: [2-[(2-chloro-6-fluoro-benzyl)-isopropyl-amino]-2-keto-ethyl]ammonium Formula: C12H17ClFN2O+ MolecularWeight: 259.727583

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=C(C=CC=C1Cl)F)C(=O)C[NH3+]

Isomeric SMILES

CC(C)N(CC1=C(C=CC=C1Cl)F)C(=O)C[NH3+]

InChI

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