[4-[(4-heptylphenyl)diazenyl]phenyl] 2-butoxypropanoate

Systemtic Name: [4-[(4-heptylphenyl)diazenyl]phenyl] 2-butoxypropanoate Openeye Name: [4-(4-heptylphenyl)azophenyl] 2-butoxypropanoate CAS Name: 2-butoxypropanoic acid [4-(4-heptylphenyl)azophenyl] ester IUPAC Name: [4-[(4-heptylphenyl)diazenyl]phenyl] 2-butoxypropanoate Traditional Name: 2-butoxypropionic acid [4-(4-heptylphenyl)azophenyl] ester Formula: C26H36N2O3 MolecularWeight: 424.57564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)N=NC2=CC=C(C=C2)OC(=O)C(C)OCCCC

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)N=NC2=CC=C(C=C2)OC(=O)C(C)OCCCC

InChI

InChI=1S/C26H36N2O3/c1-4-6-8-9-10-11-22-12-14-23(15-13-22)27-28-24-16-18-25(19-17-24)31-26(29)21(3)30-20-7-5-2/h12-19,21H,4-11,20H2,1-3H3