[1-[1-[(3-chloranyl-4-oxidanyl-phenyl)methyl]piperidin-1-ium-4-yl]piperidin-1-ium-4-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [1-[1-[(3-chloranyl-4-oxidanyl-phenyl)methyl]piperidin-1-ium-4-yl]piperidin-1-ium-4-yl]-pyrrolidin-1-yl-methanone Openeye Name: [1-[1-[(3-chloro-4-hydroxy-phenyl)methyl]piperidin-1-ium-4-yl]piperidin-1-ium-4-yl]-pyrrolidin-1-yl-methanone CAS Name: [1-[1-[(3-chloro-4-hydroxyphenyl)methyl]-4-piperidin-1-iumyl]-4-piperidin-1-iumyl]-(1-pyrrolidinyl)methanone IUPAC Name: [1-[1-[(3-chloro-4-hydroxyphenyl)methyl]piperidin-1-ium-4-yl]piperidin-1-ium-4-yl]-pyrrolidin-1-ylmethanone Traditional Name: [1-[1-(3-chloro-4-hydroxy-benzyl)piperidin-1-ium-4-yl]piperidin-1-ium-4-yl]-pyrrolidino-methanone Formula: C22H34ClN3O2+2 MolecularWeight: 407.97726

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2CC[NH+](CC2)C3CC[NH+](CC3)CC4=CC(=C(C=C4)O)Cl

Isomeric SMILES

C1CCN(C1)C(=O)C2CC[NH+](CC2)C3CC[NH+](CC3)CC4=CC(=C(C=C4)O)Cl

InChI

InChI=1S/C22H32ClN3O2/c23-20-15-17(3-4-21(20)27)16-24-11-7-19(8-12-24)25-13-5-18(6-14-25)22(28)26-9-1-2-10-26/h3-4,15,18-19,27H,1-2,5-14,16H2/p+2