[4-[1-[(5-chloranyl-2-oxidanyl-phenyl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-yl-methanone

Systemtic Name: [4-[1-[(5-chloranyl-2-oxidanyl-phenyl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-yl-methanone Openeye Name: [4-[1-[(5-chloro-2-hydroxy-phenyl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-yl-methanone CAS Name: [4-[[1-[(5-chloro-2-hydroxyphenyl)methyl]-4-piperidin-1-iumyl]oxy]phenyl]-(1-pyrrolidinyl)methanone IUPAC Name: [4-[1-[(5-chloro-2-hydroxyphenyl)methyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-ylmethanone Traditional Name: [4-[1-(5-chloro-2-hydroxy-benzyl)piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidino-methanone Formula: C23H28ClN2O3+ MolecularWeight: 415.93302

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CC4=C(C=CC(=C4)Cl)O

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CC4=C(C=CC(=C4)Cl)O

InChI

InChI=1S/C23H27ClN2O3/c24-19-5-8-22(27)18(15-19)16-25-13-9-21(10-14-25)29-20-6-3-17(4-7-20)23(28)26-11-1-2-12-26/h3-8,15,21,27H,1-2,9-14,16H2/p+1