(2S)-2-[(4-nitrophenyl)carbonylamino]-N'-oxidanyl-N-(phenylmethyl)octanediamide

Systemtic Name: (2S)-2-[(4-nitrophenyl)carbonylamino]-N'-oxidanyl-N-(phenylmethyl)octanediamide Openeye Name: N-[(1S)-1-(benzylcarbamoyl)-7-(hydroxyamino)-7-oxo-heptyl]-4-nitro-benzamide CAS Name: (2S)-N'-hydroxy-2-[[(4-nitrophenyl)-oxomethyl]amino]-N-(phenylmethyl)octanediamide IUPAC Name: (2S)-N-benzyl-N'-hydroxy-2-[(4-nitrobenzoyl)amino]octanediamide Traditional Name: N-[(1S)-1-(benzylcarbamoyl)-7-(hydroxyamino)-7-keto-heptyl]-4-nitro-benzamide Formula: C22H26N4O6 MolecularWeight: 442.46504

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C(CCCCCC(=O)NO)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)[C@H](CCCCCC(=O)NO)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C22H26N4O6/c27-20(25-30)10-6-2-5-9-19(22(29)23-15-16-7-3-1-4-8-16)24-21(28)17-11-13-18(14-12-17)26(31)32/h1,3-4,7-8,11-14,19,30H,2,5-6,9-10,15H2,(H,23,29)(H,24,28)(H,25,27)/t19-/m0/s1