4-[(E)-[2-(4-bromanyl-2-ethyl-phenoxy)ethanoylhydrazinylidene]methyl]benzoic acid

Systemtic Name: 4-[(E)-[2-(4-bromanyl-2-ethyl-phenoxy)ethanoylhydrazinylidene]methyl]benzoic acid Openeye Name: 4-[(E)-[[2-(4-bromo-2-ethyl-phenoxy)acetyl]hydrazono]methyl]benzoic acid CAS Name: 4-[(E)-[[2-(4-bromo-2-ethylphenoxy)-1-oxoethyl]hydrazinylidene]methyl]benzoic acid IUPAC Name: 4-[(E)-[[2-(4-bromo-2-ethylphenoxy)acetyl]hydrazinylidene]methyl]benzoic acid Traditional Name: 4-[(E)-[[2-(4-bromo-2-ethyl-phenoxy)acetyl]hydrazono]methyl]benzoic acid Formula: C18H17BrN2O4 MolecularWeight: 405.24258

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Br)OCC(=O)NN=CC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCC1=C(C=CC(=C1)Br)OCC(=O)N/N=C/C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C18H17BrN2O4/c1-2-13-9-15(19)7-8-16(13)25-11-17(22)21-20-10-12-3-5-14(6-4-12)18(23)24/h3-10H,2,11H2,1H3,(H,21,22)(H,23,24)/b20-10+