1-(1,2-dimethylindol-3-yl)-2-piperidin-1-ium-1-yl-ethanone

Systemtic Name: 1-(1,2-dimethylindol-3-yl)-2-piperidin-1-ium-1-yl-ethanone Openeye Name: 1-(1,2-dimethylindol-3-yl)-2-piperidin-1-ium-1-yl-ethanone CAS Name: 1-(1,2-dimethyl-3-indolyl)-2-(1-piperidin-1-iumyl)ethanone IUPAC Name: 1-(1,2-dimethylindol-3-yl)-2-piperidin-1-ium-1-ylethanone Traditional Name: 1-(1,2-dimethylindol-3-yl)-2-piperidin-1-ium-1-yl-ethanone Formula: C17H23N2O+ MolecularWeight: 271.37732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1C)C(=O)C[NH+]3CCCCC3

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1C)C(=O)C[NH+]3CCCCC3

InChI

InChI=1S/C17H22N2O/c1-13-17(14-8-4-5-9-15(14)18(13)2)16(20)12-19-10-6-3-7-11-19/h4-5,8-9H,3,6-7,10-12H2,1-2H3/p+1