[1-[1-[(2-chlorophenyl)methyl]piperidin-1-ium-4-yl]-1,2,3-triazol-4-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [1-[1-[(2-chlorophenyl)methyl]piperidin-1-ium-4-yl]-1,2,3-triazol-4-yl]-pyrrolidin-1-yl-methanone Openeye Name: [1-[1-[(2-chlorophenyl)methyl]piperidin-1-ium-4-yl]triazol-4-yl]-pyrrolidin-1-yl-methanone CAS Name: [1-[1-[(2-chlorophenyl)methyl]-4-piperidin-1-iumyl]-4-triazolyl]-(1-pyrrolidinyl)methanone IUPAC Name: [1-[1-[(2-chlorophenyl)methyl]piperidin-1-ium-4-yl]triazol-4-yl]-pyrrolidin-1-ylmethanone Traditional Name: [1-[1-(2-chlorobenzyl)piperidin-1-ium-4-yl]triazol-4-yl]-pyrrolidino-methanone Formula: C19H25ClN5O+ MolecularWeight: 374.8877

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CN(N=N2)C3CC[NH+](CC3)CC4=CC=CC=C4Cl

Isomeric SMILES

C1CCN(C1)C(=O)C2=CN(N=N2)C3CC[NH+](CC3)CC4=CC=CC=C4Cl

InChI

InChI=1S/C19H24ClN5O/c20-17-6-2-1-5-15(17)13-23-11-7-16(8-12-23)25-14-18(21-22-25)19(26)24-9-3-4-10-24/h1-2,5-6,14,16H,3-4,7-13H2/p+1