4-[(E)-[2-(4-bromanyl-2,6-dimethyl-phenoxy)ethanoylhydrazinylidene]methyl]benzoic acid

Systemtic Name: 4-[(E)-[2-(4-bromanyl-2,6-dimethyl-phenoxy)ethanoylhydrazinylidene]methyl]benzoic acid Openeye Name: 4-[(E)-[[2-(4-bromo-2,6-dimethyl-phenoxy)acetyl]hydrazono]methyl]benzoic acid CAS Name: 4-[(E)-[[2-(4-bromo-2,6-dimethylphenoxy)-1-oxoethyl]hydrazinylidene]methyl]benzoic acid IUPAC Name: 4-[(E)-[[2-(4-bromo-2,6-dimethylphenoxy)acetyl]hydrazinylidene]methyl]benzoic acid Traditional Name: 4-[(E)-[[2-(4-bromo-2,6-dimethyl-phenoxy)acetyl]hydrazono]methyl]benzoic acid Formula: C18H17BrN2O4 MolecularWeight: 405.24258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)NN=CC2=CC=C(C=C2)C(=O)O)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)N/N=C/C2=CC=C(C=C2)C(=O)O)C)Br

InChI

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