(3E)-N-(1-adamantyl)-3-[2-(4-bromanyl-3-methyl-phenoxy)ethanoylhydrazinylidene]butanamide

Systemtic Name: (3E)-N-(1-adamantyl)-3-[2-(4-bromanyl-3-methyl-phenoxy)ethanoylhydrazinylidene]butanamide Openeye Name: (3E)-N-(1-adamantyl)-3-[[2-(4-bromo-3-methyl-phenoxy)acetyl]hydrazono]butanamide CAS Name: (3E)-N-(1-adamantyl)-3-[[2-(4-bromo-3-methylphenoxy)-1-oxoethyl]hydrazinylidene]butanamide IUPAC Name: (3E)-N-(1-adamantyl)-3-[[2-(4-bromo-3-methylphenoxy)acetyl]hydrazinylidene]butanamide Traditional Name: (3E)-N-(1-adamantyl)-3-[[2-(4-bromo-3-methyl-phenoxy)acetyl]hydrazono]butyramide Formula: C23H30BrN3O3 MolecularWeight: 476.4066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)NN=C(C)CC(=O)NC23CC4CC(C2)CC(C4)C3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)N/N=C(\C)/CC(=O)NC23CC4CC(C2)CC(C4)C3)Br

InChI

InChI=1S/C23H30BrN3O3/c1-14-5-19(3-4-20(14)24)30-13-22(29)27-26-15(2)6-21(28)25-23-10-16-7-17(11-23)9-18(8-16)12-23/h3-5,16-18H,6-13H2,1-2H3,(H,25,28)(H,27,29)/b26-15+