[(2S)-3-(1H-indol-3-yl)-1-[(2-methyl-2-pyrrolidin-1-ium-1-yl-propyl)amino]-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: [(2S)-3-(1H-indol-3-yl)-1-[(2-methyl-2-pyrrolidin-1-ium-1-yl-propyl)amino]-1-oxidanylidene-propan-2-yl]azanium Openeye Name: [(1S)-1-(1H-indol-3-ylmethyl)-2-[(2-methyl-2-pyrrolidin-1-ium-1-yl-propyl)amino]-2-oxo-ethyl]ammonium CAS Name: [(2S)-3-(1H-indol-3-yl)-1-[[2-methyl-2-(1-pyrrolidin-1-iumyl)propyl]amino]-1-oxopropan-2-yl]ammonium IUPAC Name: [(2S)-3-(1H-indol-3-yl)-1-[(2-methyl-2-pyrrolidin-1-ium-1-ylpropyl)amino]-1-oxopropan-2-yl]azanium Traditional Name: [(1S)-1-(1H-indol-3-ylmethyl)-2-keto-2-[(2-methyl-2-pyrrolidin-1-ium-1-yl-propyl)amino]ethyl]ammonium Formula: C19H30N4O+2 MolecularWeight: 330.4677

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)C(CC1=CNC2=CC=CC=C21)[NH3+])[NH+]3CCCC3

Isomeric SMILES

CC(C)(CNC(=O)[C@H](CC1=CNC2=CC=CC=C21)[NH3+])[NH+]3CCCC3

InChI

InChI=1S/C19H28N4O/c1-19(2,23-9-5-6-10-23)13-22-18(24)16(20)11-14-12-21-17-8-4-3-7-15(14)17/h3-4,7-8,12,16,21H,5-6,9-11,13,20H2,1-2H3,(H,22,24)/p+2/t16-/m0/s1