[4-[(E)-[2-(4-butoxyphenoxy)ethanoylhydrazinylidene]methyl]phenyl] 3-bromanylbenzoate

Systemtic Name: [4-[(E)-[2-(4-butoxyphenoxy)ethanoylhydrazinylidene]methyl]phenyl] 3-bromanylbenzoate Openeye Name: [4-[(E)-[[2-(4-butoxyphenoxy)acetyl]hydrazono]methyl]phenyl] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [4-[(E)-[[2-(4-butoxyphenoxy)-1-oxoethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[[2-(4-butoxyphenoxy)acetyl]hydrazinylidene]methyl]phenyl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [4-[(E)-[[2-(4-butoxyphenoxy)acetyl]hydrazono]methyl]phenyl] ester Formula: C26H25BrN2O5 MolecularWeight: 525.3911

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)OCC(=O)NN=CC2=CC=C(C=C2)OC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CCCCOC1=CC=C(C=C1)OCC(=O)N/N=C/C2=CC=C(C=C2)OC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C26H25BrN2O5/c1-2-3-15-32-22-11-13-23(14-12-22)33-18-25(30)29-28-17-19-7-9-24(10-8-19)34-26(31)20-5-4-6-21(27)16-20/h4-14,16-17H,2-3,15,18H2,1H3,(H,29,30)/b28-17+