1-(1H-indol-3-yl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanone

Systemtic Name: 1-(1H-indol-3-yl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanone Openeye Name: 1-(1H-indol-3-yl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanone CAS Name: 1-(1H-indol-3-yl)-2-[(3S)-3-methyl-1-piperidin-1-iumyl]ethanone IUPAC Name: 1-(1H-indol-3-yl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanone Traditional Name: 1-(1H-indol-3-yl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanone Formula: C16H21N2O+ MolecularWeight: 257.35074

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC(=O)C2=CNC3=CC=CC=C32

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC(=O)C2=CNC3=CC=CC=C32

InChI

InChI=1S/C16H20N2O/c1-12-5-4-8-18(10-12)11-16(19)14-9-17-15-7-3-2-6-13(14)15/h2-3,6-7,9,12,17H,4-5,8,10-11H2,1H3/p+1/t12-/m0/s1