[4-[(4-butylphenyl)diazenyl]-3-chloranyl-phenyl] octanoate

Systemtic Name: [4-[(4-butylphenyl)diazenyl]-3-chloranyl-phenyl] octanoate Openeye Name: [4-(4-butylphenyl)azo-3-chloro-phenyl] octanoate CAS Name: octanoic acid [4-(4-butylphenyl)azo-3-chlorophenyl] ester IUPAC Name: [4-[(4-butylphenyl)diazenyl]-3-chlorophenyl] octanoate Traditional Name: caprylic acid [4-(4-butylphenyl)azo-3-chloro-phenyl] ester Formula: C24H31ClN2O2 MolecularWeight: 414.96814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC1=CC(=C(C=C1)N=NC2=CC=C(C=C2)CCCC)Cl

Isomeric SMILES

CCCCCCCC(=O)OC1=CC(=C(C=C1)N=NC2=CC=C(C=C2)CCCC)Cl

InChI

InChI=1S/C24H31ClN2O2/c1-3-5-7-8-9-11-24(28)29-21-16-17-23(22(25)18-21)27-26-20-14-12-19(13-15-20)10-6-4-2/h12-18H,3-11H2,1-2H3