[5-(4-bromophenyl)furan-2-yl]methyl-[2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: [5-(4-bromophenyl)furan-2-yl]methyl-[2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: [5-(4-bromophenyl)-2-furyl]methyl-[2-[(1-cyanocyclopentyl)amino]-2-oxo-ethyl]-methyl-ammonium CAS Name: [5-(4-bromophenyl)-2-furanyl]methyl-[2-[(1-cyanocyclopentyl)amino]-2-oxoethyl]-methylammonium IUPAC Name: [5-(4-bromophenyl)furan-2-yl]methyl-[2-[(1-cyanocyclopentyl)amino]-2-oxoethyl]-methylazanium Traditional Name: [5-(4-bromophenyl)-2-furyl]methyl-[2-[(1-cyanocyclopentyl)amino]-2-keto-ethyl]-methyl-ammonium Formula: C20H23BrN3O2+ MolecularWeight: 417.31952

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(O1)C2=CC=C(C=C2)Br)CC(=O)NC3(CCCC3)C#N

Isomeric SMILES

C[NH+](CC1=CC=C(O1)C2=CC=C(C=C2)Br)CC(=O)NC3(CCCC3)C#N

InChI

InChI=1S/C20H22BrN3O2/c1-24(13-19(25)23-20(14-22)10-2-3-11-20)12-17-8-9-18(26-17)15-4-6-16(21)7-5-15/h4-9H,2-3,10-13H2,1H3,(H,23,25)/p+1