[1-[1-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]piperidin-1-ium-4-yl]piperidin-1-ium-4-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [1-[1-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]piperidin-1-ium-4-yl]piperidin-1-ium-4-yl]-pyrrolidin-1-yl-methanone Openeye Name: [1-[1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]piperidin-1-ium-4-yl]piperidin-1-ium-4-yl]-pyrrolidin-1-yl-methanone CAS Name: [1-[1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-4-piperidin-1-iumyl]-4-piperidin-1-iumyl]-(1-pyrrolidinyl)methanone IUPAC Name: [1-[1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]piperidin-1-ium-4-yl]piperidin-1-ium-4-yl]-pyrrolidin-1-ylmethanone Traditional Name: [1-[1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]piperidin-1-ium-4-yl]piperidin-1-ium-4-yl]-pyrrolidino-methanone Formula: C23H34ClN3O3+2 MolecularWeight: 435.98736

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2CC[NH+](CC2)C3CC[NH+](CC3)CC4=CC5=C(C=C4Cl)OCO5

Isomeric SMILES

C1CCN(C1)C(=O)C2CC[NH+](CC2)C3CC[NH+](CC3)CC4=CC5=C(C=C4Cl)OCO5

InChI

InChI=1S/C23H32ClN3O3/c24-20-14-22-21(29-16-30-22)13-18(20)15-25-9-5-19(6-10-25)26-11-3-17(4-12-26)23(28)27-7-1-2-8-27/h13-14,17,19H,1-12,15-16H2/p+2