[4-[(E)-[2-(4-bromanylphenoxy)propanoylhydrazinylidene]methyl]phenyl] 4-butoxybenzoate

Systemtic Name: [4-[(E)-[2-(4-bromanylphenoxy)propanoylhydrazinylidene]methyl]phenyl] 4-butoxybenzoate Openeye Name: [4-[(E)-[2-(4-bromophenoxy)propanoylhydrazono]methyl]phenyl] 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid [4-[(E)-[[2-(4-bromophenoxy)-1-oxopropyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[2-(4-bromophenoxy)propanoylhydrazinylidene]methyl]phenyl] 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid [4-[(E)-[2-(4-bromophenoxy)propanoylhydrazono]methyl]phenyl] ester Formula: C27H27BrN2O5 MolecularWeight: 539.41768

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C=NNC(=O)C(C)OC3=CC=C(C=C3)Br

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)/C=N/NC(=O)C(C)OC3=CC=C(C=C3)Br

InChI

InChI=1S/C27H27BrN2O5/c1-3-4-17-33-23-13-7-21(8-14-23)27(32)35-25-11-5-20(6-12-25)18-29-30-26(31)19(2)34-24-15-9-22(28)10-16-24/h5-16,18-19H,3-4,17H2,1-2H3,(H,30,31)/b29-18+