1-(2,3-dihydroindol-1-yl)-2-(4-piperidin-1-ium-1-ylpiperidin-1-ium-1-yl)ethanone

Systemtic Name: 1-(2,3-dihydroindol-1-yl)-2-(4-piperidin-1-ium-1-ylpiperidin-1-ium-1-yl)ethanone Openeye Name: 1-indolin-1-yl-2-(4-piperidin-1-ium-1-ylpiperidin-1-ium-1-yl)ethanone CAS Name: 1-(2,3-dihydroindol-1-yl)-2-[4-(1-piperidin-1-iumyl)-1-piperidin-1-iumyl]ethanone IUPAC Name: 1-(2,3-dihydroindol-1-yl)-2-(4-piperidin-1-ium-1-ylpiperidin-1-ium-1-yl)ethanone Traditional Name: 1-indolin-1-yl-2-(4-piperidin-1-ium-1-ylpiperidin-1-ium-1-yl)ethanone Formula: C20H31N3O+2 MolecularWeight: 329.47964

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C2CC[NH+](CC2)CC(=O)N3CCC4=CC=CC=C43

Isomeric SMILES

C1CC[NH+](CC1)C2CC[NH+](CC2)CC(=O)N3CCC4=CC=CC=C43

InChI

InChI=1S/C20H29N3O/c24-20(23-15-8-17-6-2-3-7-19(17)23)16-21-13-9-18(10-14-21)22-11-4-1-5-12-22/h2-3,6-7,18H,1,4-5,8-16H2/p+2