N-(5-bromanyl-2-cyclopropylcarbonyl-1-benzofuran-3-yl)-2-pyrrolidin-1-ium-1-yl-ethanamide

Systemtic Name: N-(5-bromanyl-2-cyclopropylcarbonyl-1-benzofuran-3-yl)-2-pyrrolidin-1-ium-1-yl-ethanamide Openeye Name: N-[5-bromo-2-(cyclopropanecarbonyl)benzofuran-3-yl]-2-pyrrolidin-1-ium-1-yl-acetamide CAS Name: N-[5-bromo-2-[cyclopropyl(oxo)methyl]-3-benzofuranyl]-2-(1-pyrrolidin-1-iumyl)acetamide IUPAC Name: N-[5-bromo-2-(cyclopropanecarbonyl)-1-benzofuran-3-yl]-2-pyrrolidin-1-ium-1-ylacetamide Traditional Name: N-[5-bromo-2-(cyclopropanecarbonyl)benzofuran-3-yl]-2-pyrrolidin-1-ium-1-yl-acetamide Formula: C18H20BrN2O3+ MolecularWeight: 392.267

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC(=O)NC2=C(OC3=C2C=C(C=C3)Br)C(=O)C4CC4

Isomeric SMILES

C1CC[NH+](C1)CC(=O)NC2=C(OC3=C2C=C(C=C3)Br)C(=O)C4CC4

InChI

InChI=1S/C18H19BrN2O3/c19-12-5-6-14-13(9-12)16(18(24-14)17(23)11-3-4-11)20-15(22)10-21-7-1-2-8-21/h5-6,9,11H,1-4,7-8,10H2,(H,20,22)/p+1