N'-[(3S)-5-bromanyl-1-ethyl-2-oxidanylidene-3H-indol-3-yl]-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]ethanediamide

Systemtic Name: N'-[(3S)-5-bromanyl-1-ethyl-2-oxidanylidene-3H-indol-3-yl]-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]ethanediamide Openeye Name: N'-[(3S)-5-bromo-1-ethyl-2-oxo-indolin-3-yl]-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]oxamide CAS Name: N'-[(3S)-5-bromo-1-ethyl-2-oxo-3H-indol-3-yl]-N-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]oxamide IUPAC Name: N'-[(3S)-5-bromo-1-ethyl-2-oxo-3H-indol-3-yl]-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]oxamide Traditional Name: N'-[(3S)-5-bromo-1-ethyl-2-keto-indolin-3-yl]-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]oxamide Formula: C19H26BrN4O3+ MolecularWeight: 438.33874

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC(=O)C(=O)NC2C3=C(C=CC(=C3)Br)N(C2=O)CC

Isomeric SMILES

CC[NH+]1CCC[C@H]1CNC(=O)C(=O)N[C@H]2C3=C(C=CC(=C3)Br)N(C2=O)CC

InChI

InChI=1S/C19H25BrN4O3/c1-3-23-9-5-6-13(23)11-21-17(25)18(26)22-16-14-10-12(20)7-8-15(14)24(4-2)19(16)27/h7-8,10,13,16H,3-6,9,11H2,1-2H3,(H,21,25)(H,22,26)/p+1/t13-,16-/m0/s1