[3-[[3,4-bis(fluoranyl)phenyl]amino]-3-oxidanylidene-propyl]-ethyl-(phenylmethyl)azanium

Systemtic Name: [3-[[3,4-bis(fluoranyl)phenyl]amino]-3-oxidanylidene-propyl]-ethyl-(phenylmethyl)azanium Openeye Name: benzyl-[3-(3,4-difluoroanilino)-3-oxo-propyl]-ethyl-ammonium CAS Name: [3-(3,4-difluoroanilino)-3-oxopropyl]-ethyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[3-(3,4-difluoroanilino)-3-oxopropyl]-ethylazanium Traditional Name: benzyl-[3-(3,4-difluoroanilino)-3-keto-propyl]-ethyl-ammonium Formula: C18H21F2N2O+ MolecularWeight: 319.368946

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCC(=O)NC1=CC(=C(C=C1)F)F)CC2=CC=CC=C2

Isomeric SMILES

CC[NH+](CCC(=O)NC1=CC(=C(C=C1)F)F)CC2=CC=CC=C2

InChI

InChI=1S/C18H20F2N2O/c1-2-22(13-14-6-4-3-5-7-14)11-10-18(23)21-15-8-9-16(19)17(20)12-15/h3-9,12H,2,10-11,13H2,1H3,(H,21,23)/p+1