2-[4-acetyloxy-3-[[2-methoxy-5-(methylsulfonylaminomethyl)phenyl]diazenyl]naphthalen-1-yl]oxypropanoic acid

Systemtic Name: 2-[4-acetyloxy-3-[[2-methoxy-5-(methylsulfonylaminomethyl)phenyl]diazenyl]naphthalen-1-yl]oxypropanoic acid Openeye Name: 2-[[4-acetoxy-3-[5-(methanesulfonamidomethyl)-2-methoxy-phenyl]azo-1-naphthyl]oxy]propanoic acid CAS Name: 2-[[4-acetyloxy-3-[5-(methanesulfonamidomethyl)-2-methoxyphenyl]azo-1-naphthalenyl]oxy]propanoic acid IUPAC Name: 2-[4-acetyloxy-3-[[5-(methanesulfonamidomethyl)-2-methoxyphenyl]diazenyl]naphthalen-1-yl]oxypropanoic acid Traditional Name: 2-[4-acetoxy-3-[5-(methanesulfonamidomethyl)-2-methoxy-phenyl]azo-1-naphthoxy]propionic acid Formula: C24H25N3O8S MolecularWeight: 515.5356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)OC1=CC(=C(C2=CC=CC=C21)OC(=O)C)N=NC3=C(C=CC(=C3)CNS(=O)(=O)C)OC

Isomeric SMILES

CC(C(=O)O)OC1=CC(=C(C2=CC=CC=C21)OC(=O)C)N=NC3=C(C=CC(=C3)CNS(=O)(=O)C)OC

InChI

InChI=1S/C24H25N3O8S/c1-14(24(29)30)34-22-12-20(23(35-15(2)28)18-8-6-5-7-17(18)22)27-26-19-11-16(9-10-21(19)33-3)13-25-36(4,31)32/h5-12,14,25H,13H2,1-4H3,(H,29,30)