3-[(4-octadecanoyloxynaphthalen-1-yl)diazenyl]benzenesulfonic acid

Systemtic Name: 3-[(4-octadecanoyloxynaphthalen-1-yl)diazenyl]benzenesulfonic acid Openeye Name: 3-[(4-octadecanoyloxy-1-naphthyl)azo]benzenesulfonic acid CAS Name: 3-[[4-(1-oxooctadecoxy)-1-naphthalenyl]azo]benzenesulfonic acid IUPAC Name: 3-[(4-octadecanoyloxynaphthalen-1-yl)diazenyl]benzenesulfonic acid Traditional Name: 3-[(4-stearoyloxy-1-naphthyl)azo]besylic acid Formula: C34H46N2O5S MolecularWeight: 594.80444

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C34H46N2O5S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-24-34(37)41-33-26-25-32(30-22-17-18-23-31(30)33)36-35-28-20-19-21-29(27-28)42(38,39)40/h17-23,25-27H,2-16,24H2,1H3,(H,38,39,40)