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

Systemtic Name: 3-[(4-tetradecanoyloxynaphthalen-1-yl)diazenyl]benzenesulfonic acid Openeye Name: 3-[(4-tetradecanoyloxy-1-naphthyl)azo]benzenesulfonic acid CAS Name: 3-[[4-(1-oxotetradecoxy)-1-naphthalenyl]azo]benzenesulfonic acid IUPAC Name: 3-[(4-tetradecanoyloxynaphthalen-1-yl)diazenyl]benzenesulfonic acid Traditional Name: 3-[(4-tetradecanoyloxy-1-naphthyl)azo]besylic acid Formula: C30H38N2O5S MolecularWeight: 538.69812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H38N2O5S/c1-2-3-4-5-6-7-8-9-10-11-12-20-30(33)37-29-22-21-28(26-18-13-14-19-27(26)29)32-31-24-16-15-17-25(23-24)38(34,35)36/h13-19,21-23H,2-12,20H2,1H3,(H,34,35,36)