(4-fluoranyl-1-benzothiophen-2-yl)-[2-(propan-2-ylamino)pyridin-1-ium-1-yl]methanone

Systemtic Name: (4-fluoranyl-1-benzothiophen-2-yl)-[2-(propan-2-ylamino)pyridin-1-ium-1-yl]methanone Openeye Name: (4-fluorobenzothiophen-2-yl)-[2-(isopropylamino)pyridin-1-ium-1-yl]methanone CAS Name: (4-fluoro-1-benzothiophen-2-yl)-[2-(propan-2-ylamino)-1-pyridin-1-iumyl]methanone IUPAC Name: (4-fluoro-1-benzothiophen-2-yl)-[2-(propan-2-ylamino)pyridin-1-ium-1-yl]methanone Traditional Name: (4-fluorobenzothiophen-2-yl)-[2-(isopropylamino)pyridin-1-ium-1-yl]methanone Formula: C17H16FN2OS+ MolecularWeight: 315.385143

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=CC=CC=[N+]1C(=O)C2=CC3=C(C=CC=C3S2)F

Isomeric SMILES

CC(C)NC1=CC=CC=[N+]1C(=O)C2=CC3=C(C=CC=C3S2)F

InChI

InChI=1S/C17H15FN2OS/c1-11(2)19-16-8-3-4-9-20(16)17(21)15-10-12-13(18)6-5-7-14(12)22-15/h3-11H,1-2H3/p+1