[4-[[2-[(5-bromanylfuran-2-yl)carbonylamino]ethanoylamino]methyl]phenyl]methyl-dimethyl-azanium

Systemtic Name: [4-[[2-[(5-bromanylfuran-2-yl)carbonylamino]ethanoylamino]methyl]phenyl]methyl-dimethyl-azanium Openeye Name: [4-[[[2-[(5-bromofuran-2-carbonyl)amino]acetyl]amino]methyl]phenyl]methyl-dimethyl-ammonium CAS Name: [4-[[[2-[[(5-bromo-2-furanyl)-oxomethyl]amino]-1-oxoethyl]amino]methyl]phenyl]methyl-dimethylammonium IUPAC Name: [4-[[[2-[(5-bromofuran-2-carbonyl)amino]acetyl]amino]methyl]phenyl]methyl-dimethylazanium Traditional Name: [4-[[[2-[(5-bromo-2-furoyl)amino]acetyl]amino]methyl]benzyl]-dimethyl-ammonium Formula: C17H21BrN3O3+ MolecularWeight: 395.27094

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC=C(C=C1)CNC(=O)CNC(=O)C2=CC=C(O2)Br

Isomeric SMILES

C[NH+](C)CC1=CC=C(C=C1)CNC(=O)CNC(=O)C2=CC=C(O2)Br

InChI

InChI=1S/C17H20BrN3O3/c1-21(2)11-13-5-3-12(4-6-13)9-19-16(22)10-20-17(23)14-7-8-15(18)24-14/h3-8H,9-11H2,1-2H3,(H,19,22)(H,20,23)/p+1