N-(3-bromophenyl)-2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(3-bromophenyl)-2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(3-bromophenyl)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(3-bromophenyl)-2-[4-[2-furanyl(oxo)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(3-bromophenyl)-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(3-bromophenyl)-2-[4-(2-furoyl)piperazin-1-ium-1-yl]acetamide Formula: C17H19BrN3O3+ MolecularWeight: 393.25506

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC(=CC=C2)Br)C(=O)C3=CC=CO3

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC(=CC=C2)Br)C(=O)C3=CC=CO3

InChI

InChI=1S/C17H18BrN3O3/c18-13-3-1-4-14(11-13)19-16(22)12-20-6-8-21(9-7-20)17(23)15-5-2-10-24-15/h1-5,10-11H,6-9,12H2,(H,19,22)/p+1