[1-[1-(2-chlorophenyl)carbonylpiperidin-4-yl]piperidin-1-ium-4-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [1-[1-(2-chlorophenyl)carbonylpiperidin-4-yl]piperidin-1-ium-4-yl]-pyrrolidin-1-yl-methanone Openeye Name: [1-[1-(2-chlorobenzoyl)-4-piperidyl]piperidin-1-ium-4-yl]-pyrrolidin-1-yl-methanone CAS Name: [1-[1-[(2-chlorophenyl)-oxomethyl]-4-piperidinyl]-4-piperidin-1-iumyl]-(1-pyrrolidinyl)methanone IUPAC Name: [1-[1-(2-chlorobenzoyl)piperidin-4-yl]piperidin-1-ium-4-yl]-pyrrolidin-1-ylmethanone Traditional Name: [1-[1-(2-chlorobenzoyl)-4-piperidyl]piperidin-1-ium-4-yl]-pyrrolidino-methanone Formula: C22H31ClN3O2+ MolecularWeight: 404.95344

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2CC[NH+](CC2)C3CCN(CC3)C(=O)C4=CC=CC=C4Cl

Isomeric SMILES

C1CCN(C1)C(=O)C2CC[NH+](CC2)C3CCN(CC3)C(=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C22H30ClN3O2/c23-20-6-2-1-5-19(20)22(28)26-15-9-18(10-16-26)24-13-7-17(8-14-24)21(27)25-11-3-4-12-25/h1-2,5-6,17-18H,3-4,7-16H2/p+1