(2-chloranyl-6-fluoranyl-phenyl)methyl-methyl-[3-oxidanylidene-3-[(phenylmethyl)carbamoylamino]propyl]azanium

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl-methyl-[3-oxidanylidene-3-[(phenylmethyl)carbamoylamino]propyl]azanium Openeye Name: [3-(benzylcarbamoylamino)-3-oxo-propyl]-[(2-chloro-6-fluoro-phenyl)methyl]-methyl-ammonium CAS Name: (2-chloro-6-fluorophenyl)methyl-methyl-[3-oxo-3-[[oxo-[(phenylmethyl)amino]methyl]amino]propyl]ammonium IUPAC Name: [3-(benzylcarbamoylamino)-3-oxopropyl]-[(2-chloro-6-fluorophenyl)methyl]-methylazanium Traditional Name: [3-(benzylcarbamoylamino)-3-keto-propyl]-(2-chloro-6-fluoro-benzyl)-methyl-ammonium Formula: C19H22ClFN3O2+ MolecularWeight: 378.848283

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC(=O)NC(=O)NCC1=CC=CC=C1)CC2=C(C=CC=C2Cl)F

Isomeric SMILES

C[NH+](CCC(=O)NC(=O)NCC1=CC=CC=C1)CC2=C(C=CC=C2Cl)F

InChI

InChI=1S/C19H21ClFN3O2/c1-24(13-15-16(20)8-5-9-17(15)21)11-10-18(25)23-19(26)22-12-14-6-3-2-4-7-14/h2-9H,10-13H2,1H3,(H2,22,23,25,26)/p+1