4-[(4-octanoyloxynaphthalen-1-yl)diazenyl]benzenesulfonic acid

Systemtic Name: 4-[(4-octanoyloxynaphthalen-1-yl)diazenyl]benzenesulfonic acid Openeye Name: 4-[(4-octanoyloxy-1-naphthyl)azo]benzenesulfonic acid CAS Name: 4-[[4-(1-oxooctoxy)-1-naphthalenyl]azo]benzenesulfonic acid IUPAC Name: 4-[(4-octanoyloxynaphthalen-1-yl)diazenyl]benzenesulfonic acid Traditional Name: 4-[(4-caprylyloxy-1-naphthyl)azo]besylic acid Formula: C24H26N2O5S MolecularWeight: 454.53864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC1=CC=C(C2=CC=CC=C21)N=NC3=CC=C(C=C3)S(=O)(=O)O

Isomeric SMILES

CCCCCCCC(=O)OC1=CC=C(C2=CC=CC=C21)N=NC3=CC=C(C=C3)S(=O)(=O)O

InChI

InChI=1S/C24H26N2O5S/c1-2-3-4-5-6-11-24(27)31-23-17-16-22(20-9-7-8-10-21(20)23)26-25-18-12-14-19(15-13-18)32(28,29)30/h7-10,12-17H,2-6,11H2,1H3,(H,28,29,30)