[2-(propan-2-ylamino)pyridin-1-ium-1-yl]-(1-thiophen-2-ylcarbonylpiperidin-4-yl)methanone

Systemtic Name: [2-(propan-2-ylamino)pyridin-1-ium-1-yl]-(1-thiophen-2-ylcarbonylpiperidin-4-yl)methanone Openeye Name: [2-(isopropylamino)pyridin-1-ium-1-yl]-[1-(thiophene-2-carbonyl)-4-piperidyl]methanone CAS Name: [1-[oxo(thiophen-2-yl)methyl]-4-piperidinyl]-[2-(propan-2-ylamino)-1-pyridin-1-iumyl]methanone IUPAC Name: [2-(propan-2-ylamino)pyridin-1-ium-1-yl]-[1-(thiophene-2-carbonyl)piperidin-4-yl]methanone Traditional Name: [2-(isopropylamino)pyridin-1-ium-1-yl]-[1-(2-thenoyl)-4-piperidyl]methanone Formula: C19H24N3O2S+ MolecularWeight: 358.47776

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=CC=CC=[N+]1C(=O)C2CCN(CC2)C(=O)C3=CC=CS3

Isomeric SMILES

CC(C)NC1=CC=CC=[N+]1C(=O)C2CCN(CC2)C(=O)C3=CC=CS3

InChI

InChI=1S/C19H23N3O2S/c1-14(2)20-17-7-3-4-10-22(17)18(23)15-8-11-21(12-9-15)19(24)16-6-5-13-25-16/h3-7,10,13-15H,8-9,11-12H2,1-2H3/p+1