2,3-dihydro-1,4-benzodioxin-6-yl-[1-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-1-ium-4-yl]methanone

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[1-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-1-ium-4-yl]methanone Openeye Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[1-[[2-(2-pyridyl)thiazol-4-yl]methyl]piperidin-1-ium-4-yl]methanone CAS Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[1-[[2-(2-pyridinyl)-4-thiazolyl]methyl]-4-piperidin-1-iumyl]methanone IUPAC Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[1-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-1-ium-4-yl]methanone Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[1-[[2-(2-pyridyl)thiazol-4-yl]methyl]piperidin-1-ium-4-yl]methanone Formula: C23H24N3O3S+ MolecularWeight: 422.51996

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)C2=CC3=C(C=C2)OCCO3)CC4=CSC(=N4)C5=CC=CC=N5

Isomeric SMILES

C1C[NH+](CCC1C(=O)C2=CC3=C(C=C2)OCCO3)CC4=CSC(=N4)C5=CC=CC=N5

InChI

InChI=1S/C23H23N3O3S/c27-22(17-4-5-20-21(13-17)29-12-11-28-20)16-6-9-26(10-7-16)14-18-15-30-23(25-18)19-3-1-2-8-24-19/h1-5,8,13,15-16H,6-7,9-12,14H2/p+1