[4-[(E)-[(3-bromophenyl)carbonylhydrazinylidene]methyl]-2-ethoxy-phenyl] 4-propoxybenzoate

Systemtic Name: [4-[(E)-[(3-bromophenyl)carbonylhydrazinylidene]methyl]-2-ethoxy-phenyl] 4-propoxybenzoate Openeye Name: [4-[(E)-[(3-bromobenzoyl)hydrazono]methyl]-2-ethoxy-phenyl] 4-propoxybenzoate CAS Name: 4-propoxybenzoic acid [4-[(E)-[[(3-bromophenyl)-oxomethyl]hydrazinylidene]methyl]-2-ethoxyphenyl] ester IUPAC Name: [4-[(E)-[(3-bromobenzoyl)hydrazinylidene]methyl]-2-ethoxyphenyl] 4-propoxybenzoate Traditional Name: 4-propoxybenzoic acid [4-[(E)-[(3-bromobenzoyl)hydrazono]methyl]-2-ethoxy-phenyl] ester Formula: C26H25BrN2O5 MolecularWeight: 525.3911

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)C=NNC(=O)C3=CC(=CC=C3)Br)OCC

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)/C=N/NC(=O)C3=CC(=CC=C3)Br)OCC

InChI

InChI=1S/C26H25BrN2O5/c1-3-14-33-22-11-9-19(10-12-22)26(31)34-23-13-8-18(15-24(23)32-4-2)17-28-29-25(30)20-6-5-7-21(27)16-20/h5-13,15-17H,3-4,14H2,1-2H3,(H,29,30)/b28-17+