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

Systemtic Name: 2-[(3S)-1-(phenylmethyl)piperidin-1-ium-3-yl]-1H-benzimidazole Openeye Name: 2-[(3S)-1-benzylpiperidin-1-ium-3-yl]-1H-benzimidazole CAS Name: 2-[(3S)-1-(phenylmethyl)-3-piperidin-1-iumyl]-1H-benzimidazole IUPAC Name: 2-[(3S)-1-benzylpiperidin-1-ium-3-yl]-1H-benzimidazole Traditional Name: 2-[(3S)-1-benzylpiperidin-1-ium-3-yl]-1H-benzimidazole Formula: C19H22N3+ MolecularWeight: 292.39808

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3/c1-2-7-15(8-3-1)13-22-12-6-9-16(14-22)19-20-17-10-4-5-11-18(17)21-19/h1-5,7-8,10-11,16H,6,9,12-14H2,(H,20,21)/p+1/t16-/m0/s1