(2R)-2-hexyl-N-[(2S)-3-(1H-indol-3-yl)-1-(methylamino)-1-oxidanylidene-propan-2-yl]-N'-oxidanyl-butanediamide

Systemtic Name: (2R)-2-hexyl-N-[(2S)-3-(1H-indol-3-yl)-1-(methylamino)-1-oxidanylidene-propan-2-yl]-N'-oxidanyl-butanediamide Openeye Name: (2R)-2-[2-(hydroxyamino)-2-oxo-ethyl]-N-[(1S)-1-(1H-indol-3-ylmethyl)-2-(methylamino)-2-oxo-ethyl]octanamide CAS Name: (2R)-2-hexyl-N'-hydroxy-N-[(2S)-3-(1H-indol-3-yl)-1-(methylamino)-1-oxopropan-2-yl]butanediamide IUPAC Name: (2R)-2-hexyl-N'-hydroxy-N-[(2S)-3-(1H-indol-3-yl)-1-(methylamino)-1-oxopropan-2-yl]butanediamide Traditional Name: (2R)-2-[2-(hydroxyamino)-2-keto-ethyl]-N-[(1S)-1-(1H-indol-3-ylmethyl)-2-keto-2-(methylamino)ethyl]caprylamide Formula: C22H32N4O4 MolecularWeight: 416.51388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC(=O)NO)C(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NC

Isomeric SMILES

CCCCCC[C@H](CC(=O)NO)C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)NC

InChI

InChI=1S/C22H32N4O4/c1-3-4-5-6-9-15(13-20(27)26-30)21(28)25-19(22(29)23-2)12-16-14-24-18-11-8-7-10-17(16)18/h7-8,10-11,14-15,19,24,30H,3-6,9,12-13H2,1-2H3,(H,23,29)(H,25,28)(H,26,27)/t15-,19+/m1/s1