[(4E)-4-[(4-decylphenyl)hydrazinylidene]-3-oxidanylidene-cyclohexa-1,5-dien-1-yl] 2-methylbutanoate

Systemtic Name: [(4E)-4-[(4-decylphenyl)hydrazinylidene]-3-oxidanylidene-cyclohexa-1,5-dien-1-yl] 2-methylbutanoate Openeye Name: [(4E)-4-[(4-decylphenyl)hydrazono]-3-oxo-cyclohexa-1,5-dien-1-yl] 2-methylbutanoate CAS Name: 2-methylbutanoic acid [(4E)-4-[(4-decylphenyl)hydrazinylidene]-3-oxo-1-cyclohexa-1,5-dienyl] ester IUPAC Name: [(4E)-4-[(4-decylphenyl)hydrazinylidene]-3-oxocyclohexa-1,5-dien-1-yl] 2-methylbutanoate Traditional Name: 2-methylbutyric acid [(4E)-4-[(4-decylphenyl)hydrazono]-3-keto-cyclohexa-1,5-dien-1-yl] ester Formula: C27H38N2O3 MolecularWeight: 438.60222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CC=C(C=C1)NN=C2C=CC(=CC2=O)OC(=O)C(C)CC

Isomeric SMILES

CCCCCCCCCCC1=CC=C(C=C1)N/N=C/2\C=CC(=CC2=O)OC(=O)C(C)CC

InChI

InChI=1S/C27H38N2O3/c1-4-6-7-8-9-10-11-12-13-22-14-16-23(17-15-22)28-29-25-19-18-24(20-26(25)30)32-27(31)21(3)5-2/h14-21,28H,4-13H2,1-3H3/b29-25+