[4-(1-adamantyl)piperazin-4-ium-1-yl]-(5-bromanylfuran-2-yl)methanone

Systemtic Name: [4-(1-adamantyl)piperazin-4-ium-1-yl]-(5-bromanylfuran-2-yl)methanone Openeye Name: [4-(1-adamantyl)piperazin-4-ium-1-yl]-(5-bromo-2-furyl)methanone CAS Name: [4-(1-adamantyl)-1-piperazin-4-iumyl]-(5-bromo-2-furanyl)methanone IUPAC Name: [4-(1-adamantyl)piperazin-4-ium-1-yl]-(5-bromofuran-2-yl)methanone Traditional Name: [4-(1-adamantyl)piperazin-4-ium-1-yl]-(5-bromo-2-furyl)methanone Formula: C19H26BrN2O2+ MolecularWeight: 394.32594

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C23CC4CC(C2)CC(C4)C3)C(=O)C5=CC=C(O5)Br

Isomeric SMILES

C1CN(CC[NH+]1C23CC4CC(C2)CC(C4)C3)C(=O)C5=CC=C(O5)Br

InChI

InChI=1S/C19H25BrN2O2/c20-17-2-1-16(24-17)18(23)21-3-5-22(6-4-21)19-10-13-7-14(11-19)9-15(8-13)12-19/h1-2,13-15H,3-12H2/p+1