2-[(2S)-2-(2-hydroxyethyl)piperidin-1-ium-1-yl]-1-(2-methyl-1H-indol-3-yl)ethanone

Systemtic Name: 2-[(2S)-2-(2-hydroxyethyl)piperidin-1-ium-1-yl]-1-(2-methyl-1H-indol-3-yl)ethanone Openeye Name: 2-[(2S)-2-(2-hydroxyethyl)piperidin-1-ium-1-yl]-1-(2-methyl-1H-indol-3-yl)ethanone CAS Name: 2-[(2S)-2-(2-hydroxyethyl)-1-piperidin-1-iumyl]-1-(2-methyl-1H-indol-3-yl)ethanone IUPAC Name: 2-[(2S)-2-(2-hydroxyethyl)piperidin-1-ium-1-yl]-1-(2-methyl-1H-indol-3-yl)ethanone Traditional Name: 2-[(2S)-2-(2-hydroxyethyl)piperidin-1-ium-1-yl]-1-(2-methyl-1H-indol-3-yl)ethanone Formula: C18H25N2O2+ MolecularWeight: 301.4033

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)C[NH+]3CCCCC3CCO

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)C[NH+]3CCCC[C@H]3CCO

InChI

InChI=1S/C18H24N2O2/c1-13-18(15-7-2-3-8-16(15)19-13)17(22)12-20-10-5-4-6-14(20)9-11-21/h2-3,7-8,14,19,21H,4-6,9-12H2,1H3/p+1/t14-/m0/s1