(2S)-N-(4-dimethylaminophenyl)-N'-oxidanyl-2-[[(E)-3-phenylprop-2-enoyl]amino]octanediamide

Systemtic Name: (2S)-N-(4-dimethylaminophenyl)-N'-oxidanyl-2-[[(E)-3-phenylprop-2-enoyl]amino]octanediamide Openeye Name: (2S)-N-(4-dimethylaminophenyl)-8-(hydroxyamino)-8-oxo-2-[[(E)-3-phenylprop-2-enoyl]amino]octanamide CAS Name: (2S)-N-(4-dimethylaminophenyl)-N'-hydroxy-2-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]octanediamide IUPAC Name: (2S)-N-(4-dimethylaminophenyl)-N'-hydroxy-2-[[(E)-3-phenylprop-2-enoyl]amino]octanediamide Traditional Name: (2S)-N-(4-dimethylaminophenyl)-8-(hydroxyamino)-8-keto-2-[[(E)-3-phenylacryloyl]amino]caprylamide Formula: C25H32N4O4 MolecularWeight: 452.54598

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)NC(=O)C(CCCCCC(=O)NO)NC(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CN(C)C1=CC=C(C=C1)NC(=O)[C@H](CCCCCC(=O)NO)NC(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C25H32N4O4/c1-29(2)21-16-14-20(15-17-21)26-25(32)22(11-7-4-8-12-24(31)28-33)27-23(30)18-13-19-9-5-3-6-10-19/h3,5-6,9-10,13-18,22,33H,4,7-8,11-12H2,1-2H3,(H,26,32)(H,27,30)(H,28,31)/b18-13+/t22-/m0/s1