(2S)-1-(2-methyl-1H-indol-3-yl)-2-pyrrolidin-1-ium-1-yl-propan-1-one

Systemtic Name: (2S)-1-(2-methyl-1H-indol-3-yl)-2-pyrrolidin-1-ium-1-yl-propan-1-one Openeye Name: (2S)-1-(2-methyl-1H-indol-3-yl)-2-pyrrolidin-1-ium-1-yl-propan-1-one CAS Name: (2S)-1-(2-methyl-1H-indol-3-yl)-2-(1-pyrrolidin-1-iumyl)-1-propanone IUPAC Name: (2S)-1-(2-methyl-1H-indol-3-yl)-2-pyrrolidin-1-ium-1-ylpropan-1-one Traditional Name: (2S)-1-(2-methyl-1H-indol-3-yl)-2-pyrrolidin-1-ium-1-yl-propan-1-one Formula: C16H21N2O+ MolecularWeight: 257.35074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)C(C)[NH+]3CCCC3

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)[C@H](C)[NH+]3CCCC3

InChI

InChI=1S/C16H20N2O/c1-11-15(13-7-3-4-8-14(13)17-11)16(19)12(2)18-9-5-6-10-18/h3-4,7-8,12,17H,5-6,9-10H2,1-2H3/p+1/t12-/m0/s1