[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]-[2-[4-[(2-fluorophenyl)methyl]piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: [2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]-[2-[4-[(2-fluorophenyl)methyl]piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: [2-(4-chloroanilino)-2-oxo-ethyl]-[2-[4-[(2-fluorophenyl)methyl]piperazin-4-ium-1-yl]-2-oxo-ethyl]-methyl-ammonium CAS Name: [2-(4-chloroanilino)-2-oxoethyl]-[2-[4-[(2-fluorophenyl)methyl]-1-piperazin-4-iumyl]-2-oxoethyl]-methylammonium IUPAC Name: [2-(4-chloroanilino)-2-oxoethyl]-[2-[4-[(2-fluorophenyl)methyl]piperazin-4-ium-1-yl]-2-oxoethyl]-methylazanium Traditional Name: [2-(4-chloroanilino)-2-keto-ethyl]-[2-[4-(2-fluorobenzyl)piperazin-4-ium-1-yl]-2-keto-ethyl]-methyl-ammonium Formula: C22H28ClFN4O2+2 MolecularWeight: 434.934723

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC(=O)NC1=CC=C(C=C1)Cl)CC(=O)N2CC[NH+](CC2)CC3=CC=CC=C3F

Isomeric SMILES

C[NH+](CC(=O)NC1=CC=C(C=C1)Cl)CC(=O)N2CC[NH+](CC2)CC3=CC=CC=C3F

InChI

InChI=1S/C22H26ClFN4O2/c1-26(15-21(29)25-19-8-6-18(23)7-9-19)16-22(30)28-12-10-27(11-13-28)14-17-4-2-3-5-20(17)24/h2-9H,10-16H2,1H3,(H,25,29)/p+2