N-[1-[2-[(3-ethoxy-5-iodanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]-3-methyl-1-oxidanylidene-butan-2-yl]-2-fluoranyl-benzamide

Systemtic Name: N-[1-[2-[(3-ethoxy-5-iodanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]-3-methyl-1-oxidanylidene-butan-2-yl]-2-fluoranyl-benzamide Openeye Name: N-[1-[[(3-ethoxy-5-iodo-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]-2-methyl-propyl]-2-fluoro-benzamide CAS Name: N-[1-[(3-ethoxy-5-iodo-4-oxo-1-cyclohexa-2,5-dienylidene)methylhydrazo]-3-methyl-1-oxobutan-2-yl]-2-fluorobenzamide IUPAC Name: N-[1-[2-[(3-ethoxy-5-iodo-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]-3-methyl-1-oxobutan-2-yl]-2-fluorobenzamide Traditional Name: N-[1-[[(3-ethoxy-5-iodo-4-keto-cyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]-2-methyl-propyl]-2-fluoro-benzamide Formula: C21H23FIN3O4 MolecularWeight: 527.327893

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CNNC(=O)C(C(C)C)NC(=O)C2=CC=CC=C2F)C=C(C1=O)I

Isomeric SMILES

CCOC1=CC(=CNNC(=O)C(C(C)C)NC(=O)C2=CC=CC=C2F)C=C(C1=O)I

InChI

InChI=1S/C21H23FIN3O4/c1-4-30-17-10-13(9-16(23)19(17)27)11-24-26-21(29)18(12(2)3)25-20(28)14-7-5-6-8-15(14)22/h5-12,18,24H,4H2,1-3H3,(H,25,28)(H,26,29)