2-[(3S)-1-[(3-chlorophenyl)methyl]piperidin-1-ium-3-yl]-1H-benzimidazole

Systemtic Name: 2-[(3S)-1-[(3-chlorophenyl)methyl]piperidin-1-ium-3-yl]-1H-benzimidazole Openeye Name: 2-[(3S)-1-[(3-chlorophenyl)methyl]piperidin-1-ium-3-yl]-1H-benzimidazole CAS Name: 2-[(3S)-1-[(3-chlorophenyl)methyl]-3-piperidin-1-iumyl]-1H-benzimidazole IUPAC Name: 2-[(3S)-1-[(3-chlorophenyl)methyl]piperidin-1-ium-3-yl]-1H-benzimidazole Traditional Name: 2-[(3S)-1-(3-chlorobenzyl)piperidin-1-ium-3-yl]-1H-benzimidazole Formula: C19H21ClN3+ MolecularWeight: 326.84314

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC(=CC=C2)Cl)C3=NC4=CC=CC=C4N3

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=CC(=CC=C2)Cl)C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C19H20ClN3/c20-16-7-3-5-14(11-16)12-23-10-4-6-15(13-23)19-21-17-8-1-2-9-18(17)22-19/h1-3,5,7-9,11,15H,4,6,10,12-13H2,(H,21,22)/p+1/t15-/m0/s1