3-[4-(4-thiophen-2-ylpyridin-1-ium-1-yl)butyl]-1H-indole

Systemtic Name: 3-[4-(4-thiophen-2-ylpyridin-1-ium-1-yl)butyl]-1H-indole Openeye Name: 3-[4-[4-(2-thienyl)pyridin-1-ium-1-yl]butyl]-1H-indole CAS Name: 3-[4-(4-thiophen-2-yl-1-pyridin-1-iumyl)butyl]-1H-indole IUPAC Name: 3-[4-(4-thiophen-2-ylpyridin-1-ium-1-yl)butyl]-1H-indole Traditional Name: 3-[4-[4-(2-thienyl)pyridin-1-ium-1-yl]butyl]-1H-indole Formula: C21H21N2S+ MolecularWeight: 333.46984

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CCCC[N+]3=CC=C(C=C3)C4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CCCC[N+]3=CC=C(C=C3)C4=CC=CS4

InChI

InChI=1S/C21H21N2S/c1-2-8-20-19(7-1)18(16-22-20)6-3-4-12-23-13-10-17(11-14-23)21-9-5-15-24-21/h1-2,5,7-11,13-16,22H,3-4,6,12H2/q+1