3-[2-[2-[(4-ethylphenyl)amino]-2-oxidanylidene-ethanoyl]hydrazinyl]-N-(3-iodanylphenyl)but-3-enamide

Systemtic Name: 3-[2-[2-[(4-ethylphenyl)amino]-2-oxidanylidene-ethanoyl]hydrazinyl]-N-(3-iodanylphenyl)but-3-enamide Openeye Name: 3-[2-[2-(4-ethylanilino)-2-oxo-acetyl]hydrazino]-N-(3-iodophenyl)but-3-enamide CAS Name: 3-[[2-(4-ethylanilino)-1,2-dioxoethyl]hydrazo]-N-(3-iodophenyl)-3-butenamide IUPAC Name: 3-[2-[2-(4-ethylanilino)-2-oxoacetyl]hydrazinyl]-N-(3-iodophenyl)but-3-enamide Traditional Name: 3-[N'-[2-(4-ethylanilino)-2-keto-acetyl]hydrazino]-N-(3-iodophenyl)but-3-enamide Formula: C20H21IN4O3 MolecularWeight: 492.31021

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C(=O)NNC(=C)CC(=O)NC2=CC(=CC=C2)I

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C(=O)NNC(=C)CC(=O)NC2=CC(=CC=C2)I

InChI

InChI=1S/C20H21IN4O3/c1-3-14-7-9-16(10-8-14)23-19(27)20(28)25-24-13(2)11-18(26)22-17-6-4-5-15(21)12-17/h4-10,12,24H,2-3,11H2,1H3,(H,22,26)(H,23,27)(H,25,28)