[1-[1-(3-chlorophenyl)carbonylpiperidin-4-yl]piperidin-1-ium-4-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [1-[1-(3-chlorophenyl)carbonylpiperidin-4-yl]piperidin-1-ium-4-yl]-pyrrolidin-1-yl-methanone Openeye Name: [1-[1-(3-chlorobenzoyl)-4-piperidyl]piperidin-1-ium-4-yl]-pyrrolidin-1-yl-methanone CAS Name: [1-[1-[(3-chlorophenyl)-oxomethyl]-4-piperidinyl]-4-piperidin-1-iumyl]-(1-pyrrolidinyl)methanone IUPAC Name: [1-[1-(3-chlorobenzoyl)piperidin-4-yl]piperidin-1-ium-4-yl]-pyrrolidin-1-ylmethanone Traditional Name: [1-[1-(3-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=C4)Cl

Isomeric SMILES

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

InChI

InChI=1S/C22H30ClN3O2/c23-19-5-3-4-18(16-19)22(28)26-14-8-20(9-15-26)24-12-6-17(7-13-24)21(27)25-10-1-2-11-25/h3-5,16-17,20H,1-2,6-15H2/p+1