(2S)-2-azanyl-3-(1H-indol-3-yl)-1-(2-methyl-4,5-dihydro-1H-imidazol-3-ium-3-yl)propan-1-one

Systemtic Name: (2S)-2-azanyl-3-(1H-indol-3-yl)-1-(2-methyl-4,5-dihydro-1H-imidazol-3-ium-3-yl)propan-1-one Openeye Name: (2S)-2-amino-3-(1H-indol-3-yl)-1-(2-methyl-4,5-dihydro-1H-imidazol-3-ium-3-yl)propan-1-one CAS Name: (2S)-2-amino-3-(1H-indol-3-yl)-1-(2-methyl-4,5-dihydro-1H-imidazol-3-ium-3-yl)-1-propanone IUPAC Name: (2S)-2-amino-3-(1H-indol-3-yl)-1-(2-methyl-4,5-dihydro-1H-imidazol-3-ium-3-yl)propan-1-one Traditional Name: (2S)-2-amino-3-(1H-indol-3-yl)-1-(2-methyl-2-imidazolin-1-ium-1-yl)propan-1-one Formula: C15H19N4O+ MolecularWeight: 271.33756

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

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+1/t13-/m0/s1