(2S)-2-[4-(1H-indol-3-yl)butanoylamino]-N'-oxidanyl-N-(phenylmethyl)octanediamide

Systemtic Name: (2S)-2-[4-(1H-indol-3-yl)butanoylamino]-N'-oxidanyl-N-(phenylmethyl)octanediamide Openeye Name: (2S)-N-benzyl-8-(hydroxyamino)-2-[4-(1H-indol-3-yl)butanoylamino]-8-oxo-octanamide CAS Name: (2S)-N'-hydroxy-2-[[4-(1H-indol-3-yl)-1-oxobutyl]amino]-N-(phenylmethyl)octanediamide IUPAC Name: (2S)-N-benzyl-N'-hydroxy-2-[4-(1H-indol-3-yl)butanoylamino]octanediamide Traditional Name: (2S)-N-benzyl-8-(hydroxyamino)-2-[4-(1H-indol-3-yl)butanoylamino]-8-keto-caprylamide Formula: C27H34N4O4 MolecularWeight: 478.58326

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C(CCCCCC(=O)NO)NC(=O)CCCC2=CNC3=CC=CC=C32

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)[C@H](CCCCCC(=O)NO)NC(=O)CCCC2=CNC3=CC=CC=C32

InChI

InChI=1S/C27H34N4O4/c32-25(17-9-12-21-19-28-23-14-8-7-13-22(21)23)30-24(15-5-2-6-16-26(33)31-35)27(34)29-18-20-10-3-1-4-11-20/h1,3-4,7-8,10-11,13-14,19,24,28,35H,2,5-6,9,12,15-18H2,(H,29,34)(H,30,32)(H,31,33)/t24-/m0/s1