[4-[(4-oxidanylpiperidin-1-ium-1-yl)methyl]phenyl]-pyrrolidin-1-yl-methanone

Systemtic Name: [4-[(4-oxidanylpiperidin-1-ium-1-yl)methyl]phenyl]-pyrrolidin-1-yl-methanone Openeye Name: [4-[(4-hydroxypiperidin-1-ium-1-yl)methyl]phenyl]-pyrrolidin-1-yl-methanone CAS Name: [4-[(4-hydroxy-1-piperidin-1-iumyl)methyl]phenyl]-(1-pyrrolidinyl)methanone IUPAC Name: [4-[(4-hydroxypiperidin-1-ium-1-yl)methyl]phenyl]-pyrrolidin-1-ylmethanone Traditional Name: [4-[(4-hydroxypiperidin-1-ium-1-yl)methyl]phenyl]-pyrrolidino-methanone Formula: C17H25N2O2+ MolecularWeight: 289.3926

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC=C(C=C2)C[NH+]3CCC(CC3)O

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC=C(C=C2)C[NH+]3CCC(CC3)O

InChI

InChI=1S/C17H24N2O2/c20-16-7-11-18(12-8-16)13-14-3-5-15(6-4-14)17(21)19-9-1-2-10-19/h3-6,16,20H,1-2,7-13H2/p+1