1-[6-[[1-(phenylmethyl)piperidin-1-ium-4-yl]amino]-2,3-dihydroindol-1-yl]ethanone

Systemtic Name: 1-[6-[[1-(phenylmethyl)piperidin-1-ium-4-yl]amino]-2,3-dihydroindol-1-yl]ethanone Openeye Name: 1-[6-[(1-benzylpiperidin-1-ium-4-yl)amino]indolin-1-yl]ethanone CAS Name: 1-[6-[[1-(phenylmethyl)-4-piperidin-1-iumyl]amino]-2,3-dihydroindol-1-yl]ethanone IUPAC Name: 1-[6-[(1-benzylpiperidin-1-ium-4-yl)amino]-2,3-dihydroindol-1-yl]ethanone Traditional Name: 1-[6-[(1-benzylpiperidin-1-ium-4-yl)amino]indolin-1-yl]ethanone Formula: C22H28N3O+ MolecularWeight: 350.47722

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=C1C=C(C=C2)NC3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

CC(=O)N1CCC2=C1C=C(C=C2)NC3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C22H27N3O/c1-17(26)25-14-9-19-7-8-21(15-22(19)25)23-20-10-12-24(13-11-20)16-18-5-3-2-4-6-18/h2-8,15,20,23H,9-14,16H2,1H3/p+1