3-[2-[2-(2-bromanyl-4-methyl-phenoxy)ethanoyl]hydrazinyl]-N-(4-dimethylaminophenyl)but-3-enamide

Systemtic Name: 3-[2-[2-(2-bromanyl-4-methyl-phenoxy)ethanoyl]hydrazinyl]-N-(4-dimethylaminophenyl)but-3-enamide Openeye Name: 3-[2-[2-(2-bromo-4-methyl-phenoxy)acetyl]hydrazino]-N-(4-dimethylaminophenyl)but-3-enamide CAS Name: 3-[[2-(2-bromo-4-methylphenoxy)-1-oxoethyl]hydrazo]-N-(4-dimethylaminophenyl)-3-butenamide IUPAC Name: 3-[2-[2-(2-bromo-4-methylphenoxy)acetyl]hydrazinyl]-N-(4-dimethylaminophenyl)but-3-enamide Traditional Name: 3-[N'-[2-(2-bromo-4-methyl-phenoxy)acetyl]hydrazino]-N-(4-dimethylaminophenyl)but-3-enamide Formula: C21H25BrN4O3 MolecularWeight: 461.3522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)NNC(=C)CC(=O)NC2=CC=C(C=C2)N(C)C)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)NNC(=C)CC(=O)NC2=CC=C(C=C2)N(C)C)Br

InChI

InChI=1S/C21H25BrN4O3/c1-14-5-10-19(18(22)11-14)29-13-21(28)25-24-15(2)12-20(27)23-16-6-8-17(9-7-16)26(3)4/h5-11,24H,2,12-13H2,1,3-4H3,(H,23,27)(H,25,28)