[4-[(4-butylphenyl)diazenyl]phenyl] 3-methylbutanoate

Systemtic Name: [4-[(4-butylphenyl)diazenyl]phenyl] 3-methylbutanoate Openeye Name: [4-(4-butylphenyl)azophenyl] 3-methylbutanoate CAS Name: 3-methylbutanoic acid [4-(4-butylphenyl)azophenyl] ester IUPAC Name: [4-[(4-butylphenyl)diazenyl]phenyl] 3-methylbutanoate Traditional Name: 3-methylbutyric acid [4-(4-butylphenyl)azophenyl] ester Formula: C21H26N2O2 MolecularWeight: 338.44334

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N=NC2=CC=C(C=C2)OC(=O)CC(C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)N=NC2=CC=C(C=C2)OC(=O)CC(C)C

InChI

InChI=1S/C21H26N2O2/c1-4-5-6-17-7-9-18(10-8-17)22-23-19-11-13-20(14-12-19)25-21(24)15-16(2)3/h7-14,16H,4-6,15H2,1-3H3