(2S)-2-[3-[3-[[8-(oxidanylamino)-8-oxidanylidene-octanoyl]amino]phenoxy]propylamino]-2-phenyl-ethanoic acid

Systemtic Name: (2S)-2-[3-[3-[[8-(oxidanylamino)-8-oxidanylidene-octanoyl]amino]phenoxy]propylamino]-2-phenyl-ethanoic acid Openeye Name: (2S)-2-[3-[3-[[8-(hydroxyamino)-8-oxo-octanoyl]amino]phenoxy]propylamino]-2-phenyl-acetic acid CAS Name: (2S)-2-[3-[3-[[8-(hydroxyamino)-1,8-dioxooctyl]amino]phenoxy]propylamino]-2-phenylacetic acid IUPAC Name: (2S)-2-[3-[3-[[8-(hydroxyamino)-8-oxooctanoyl]amino]phenoxy]propylamino]-2-phenylacetic acid Traditional Name: (2S)-2-[3-[3-[[8-(hydroxyamino)-8-keto-octanoyl]amino]phenoxy]propylamino]-2-phenyl-acetic acid Formula: C25H33N3O6 MolecularWeight: 471.54602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)O)NCCCOC2=CC=CC(=C2)NC(=O)CCCCCCC(=O)NO

Isomeric SMILES

C1=CC=C(C=C1)[C@@H](C(=O)O)NCCCOC2=CC=CC(=C2)NC(=O)CCCCCCC(=O)NO

InChI

InChI=1S/C25H33N3O6/c29-22(14-6-1-2-7-15-23(30)28-33)27-20-12-8-13-21(18-20)34-17-9-16-26-24(25(31)32)19-10-4-3-5-11-19/h3-5,8,10-13,18,24,26,33H,1-2,6-7,9,14-17H2,(H,27,29)(H,28,30)(H,31,32)/t24-/m0/s1