6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(2-piperidin-1-ium-1-yl-1,3-dihydroinden-2-yl)methanone

Systemtic Name: 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(2-piperidin-1-ium-1-yl-1,3-dihydroinden-2-yl)methanone Openeye Name: 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(2-piperidin-1-ium-1-ylindan-2-yl)methanone CAS Name: 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-[2-(1-piperidin-1-iumyl)-1,3-dihydroinden-2-yl]methanone IUPAC Name: 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(2-piperidin-1-ium-1-yl-1,3-dihydroinden-2-yl)methanone Traditional Name: 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(2-piperidin-1-ium-1-ylindan-2-yl)methanone Formula: C22H27N2OS+ MolecularWeight: 367.52758

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C2(CC3=CC=CC=C3C2)C(=O)N4CCC5=C(C4)C=CS5

Isomeric SMILES

C1CC[NH+](CC1)C2(CC3=CC=CC=C3C2)C(=O)N4CCC5=C(C4)C=CS5

InChI

InChI=1S/C22H26N2OS/c25-21(23-12-8-20-19(16-23)9-13-26-20)22(24-10-4-1-5-11-24)14-17-6-2-3-7-18(17)15-22/h2-3,6-7,9,13H,1,4-5,8,10-12,14-16H2/p+1