[(2S)-3-(1H-indol-3-yl)-1-(2-methyl-4,5-dihydro-1H-imidazol-3-ium-3-yl)-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: [(2S)-3-(1H-indol-3-yl)-1-(2-methyl-4,5-dihydro-1H-imidazol-3-ium-3-yl)-1-oxidanylidene-propan-2-yl]azanium Openeye Name: [(1S)-1-(1H-indol-3-ylmethyl)-2-(2-methyl-4,5-dihydro-1H-imidazol-3-ium-3-yl)-2-oxo-ethyl]ammonium CAS Name: [(2S)-3-(1H-indol-3-yl)-1-(2-methyl-4,5-dihydro-1H-imidazol-3-ium-3-yl)-1-oxopropan-2-yl]ammonium IUPAC Name: [(2S)-3-(1H-indol-3-yl)-1-(2-methyl-4,5-dihydro-1H-imidazol-3-ium-3-yl)-1-oxopropan-2-yl]azanium Traditional Name: [(1S)-1-(1H-indol-3-ylmethyl)-2-keto-2-(2-methyl-2-imidazolin-1-ium-1-yl)ethyl]ammonium Formula: C15H20N4O+2 MolecularWeight: 272.3455

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](CCN1)C(=O)C(CC2=CNC3=CC=CC=C32)[NH3+]

Isomeric SMILES

CC1=[N+](CCN1)C(=O)[C@H](CC2=CNC3=CC=CC=C32)[NH3+]

InChI

InChI=1S/C15H18N4O/c1-10-17-6-7-19(10)15(20)13(16)8-11-9-18-14-5-3-2-4-12(11)14/h2-5,9,13,18H,6-8,16H2,1H3/p+2/t13-/m0/s1