2-[[(2S)-2-azaniumyl-3-(1H-indol-3-yl)propanoyl]amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[(2S)-2-azaniumyl-3-(1H-indol-3-yl)propanoyl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[[(2S)-2-azaniumyl-3-(1H-indol-3-yl)propanoyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[(2S)-2-ammonio-3-(1H-indol-3-yl)-1-oxopropyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[(2S)-2-azaniumyl-3-(1H-indol-3-yl)propanoyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[(2S)-2-ammonio-3-(1H-indol-3-yl)propanoyl]amino]ethyl-dimethyl-ammonium Formula: C15H24N4O+2 MolecularWeight: 276.37726

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=O)C(CC1=CNC2=CC=CC=C21)[NH3+]

Isomeric SMILES

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

InChI

InChI=1S/C15H22N4O/c1-19(2)8-7-17-15(20)13(16)9-11-10-18-14-6-4-3-5-12(11)14/h3-6,10,13,18H,7-9,16H2,1-2H3,(H,17,20)/p+2/t13-/m0/s1