[4-[(4-pentanoylphenyl)diazenyl]phenyl] octadecanoate

Systemtic Name: [4-[(4-pentanoylphenyl)diazenyl]phenyl] octadecanoate Openeye Name: [4-(4-pentanoylphenyl)azophenyl] octadecanoate CAS Name: octadecanoic acid [4-[4-(1-oxopentyl)phenyl]azophenyl] ester IUPAC Name: [4-[(4-pentanoylphenyl)diazenyl]phenyl] octadecanoate Traditional Name: stearic acid [4-(4-valerylphenyl)azophenyl] ester Formula: C35H52N2O3 MolecularWeight: 548.79898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C35H52N2O3/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-21-35(39)40-33-28-26-32(27-29-33)37-36-31-24-22-30(23-25-31)34(38)20-6-4-2/h22-29H,3-21H2,1-2H3