[1-[(5-bromanyl-2-oxidanyl-phenyl)methyl]piperidin-1-ium-3-yl]-piperidin-1-yl-methanone

Systemtic Name: [1-[(5-bromanyl-2-oxidanyl-phenyl)methyl]piperidin-1-ium-3-yl]-piperidin-1-yl-methanone Openeye Name: [1-[(5-bromo-2-hydroxy-phenyl)methyl]piperidin-1-ium-3-yl]-(1-piperidyl)methanone CAS Name: [1-[(5-bromo-2-hydroxyphenyl)methyl]-3-piperidin-1-iumyl]-(1-piperidinyl)methanone IUPAC Name: [1-[(5-bromo-2-hydroxyphenyl)methyl]piperidin-1-ium-3-yl]-piperidin-1-ylmethanone Traditional Name: [1-(5-bromo-2-hydroxy-benzyl)piperidin-1-ium-3-yl]-piperidino-methanone Formula: C18H26BrN2O2+ MolecularWeight: 382.31524

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2CCC[NH+](C2)CC3=C(C=CC(=C3)Br)O

Isomeric SMILES

C1CCN(CC1)C(=O)C2CCC[NH+](C2)CC3=C(C=CC(=C3)Br)O

InChI

InChI=1S/C18H25BrN2O2/c19-16-6-7-17(22)15(11-16)13-20-8-4-5-14(12-20)18(23)21-9-2-1-3-10-21/h6-7,11,14,22H,1-5,8-10,12-13H2/p+1