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

Systemtic Name: 2-[(E)-[4-(2-bromanyl-4-methyl-phenoxy)butanoylhydrazinylidene]methyl]benzoic acid Openeye Name: 2-[(E)-[4-(2-bromo-4-methyl-phenoxy)butanoylhydrazono]methyl]benzoic acid CAS Name: 2-[(E)-[[4-(2-bromo-4-methylphenoxy)-1-oxobutyl]hydrazinylidene]methyl]benzoic acid IUPAC Name: 2-[(E)-[4-(2-bromo-4-methylphenoxy)butanoylhydrazinylidene]methyl]benzoic acid Traditional Name: 2-[(E)-[4-(2-bromo-4-methyl-phenoxy)butanoylhydrazono]methyl]benzoic acid Formula: C19H19BrN2O4 MolecularWeight: 419.26916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCCC(=O)NN=CC2=CC=CC=C2C(=O)O)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OCCCC(=O)N/N=C/C2=CC=CC=C2C(=O)O)Br

InChI

InChI=1S/C19H19BrN2O4/c1-13-8-9-17(16(20)11-13)26-10-4-7-18(23)22-21-12-14-5-2-3-6-15(14)19(24)25/h2-3,5-6,8-9,11-12H,4,7,10H2,1H3,(H,22,23)(H,24,25)/b21-12+