2-[[(3-ethoxy-5-iodanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]-N-(4-methoxyphenyl)-3-methyl-butanamide

Systemtic Name: 2-[[(3-ethoxy-5-iodanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]-N-(4-methoxyphenyl)-3-methyl-butanamide Openeye Name: 2-[[(3-ethoxy-5-iodo-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]-N-(4-methoxyphenyl)-3-methyl-butanamide CAS Name: 2-[[(3-ethoxy-5-iodo-4-oxo-1-cyclohexa-2,5-dienylidene)methylhydrazo]-oxomethyl]-N-(4-methoxyphenyl)-3-methylbutanamide IUPAC Name: 2-[[(3-ethoxy-5-iodo-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]-N-(4-methoxyphenyl)-3-methylbutanamide Traditional Name: 2-[[(3-ethoxy-5-iodo-4-keto-cyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]-N-(4-methoxyphenyl)-3-methyl-butyramide Formula: C22H26IN3O5 MolecularWeight: 539.36341

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CNNC(=O)C(C(C)C)C(=O)NC2=CC=C(C=C2)OC)C=C(C1=O)I

Isomeric SMILES

CCOC1=CC(=CNNC(=O)C(C(C)C)C(=O)NC2=CC=C(C=C2)OC)C=C(C1=O)I

InChI

InChI=1S/C22H26IN3O5/c1-5-31-18-11-14(10-17(23)20(18)27)12-24-26-22(29)19(13(2)3)21(28)25-15-6-8-16(30-4)9-7-15/h6-13,19,24H,5H2,1-4H3,(H,25,28)(H,26,29)