(3Z)-N-(2-adamantyl)-3-[2-(4-bromanylphenoxy)ethanoylhydrazinylidene]butanamide

Systemtic Name: (3Z)-N-(2-adamantyl)-3-[2-(4-bromanylphenoxy)ethanoylhydrazinylidene]butanamide Openeye Name: (3Z)-N-(2-adamantyl)-3-[[2-(4-bromophenoxy)acetyl]hydrazono]butanamide CAS Name: (3Z)-N-(2-adamantyl)-3-[[2-(4-bromophenoxy)-1-oxoethyl]hydrazinylidene]butanamide IUPAC Name: (3Z)-N-(2-adamantyl)-3-[[2-(4-bromophenoxy)acetyl]hydrazinylidene]butanamide Traditional Name: (3Z)-N-(2-adamantyl)-3-[[2-(4-bromophenoxy)acetyl]hydrazono]butyramide Formula: C22H28BrN3O3 MolecularWeight: 462.38002

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)COC1=CC=C(C=C1)Br)CC(=O)NC2C3CC4CC(C3)CC2C4

Isomeric SMILES

C/C(=N/NC(=O)COC1=CC=C(C=C1)Br)/CC(=O)NC2C3CC4CC(C3)CC2C4

InChI

InChI=1S/C22H28BrN3O3/c1-13(25-26-21(28)12-29-19-4-2-18(23)3-5-19)6-20(27)24-22-16-8-14-7-15(10-16)11-17(22)9-14/h2-5,14-17,22H,6-12H2,1H3,(H,24,27)(H,26,28)/b25-13-