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

Systemtic Name: N-(2,3-dimethylphenyl)-4-[2-[(3-ethoxy-5-iodanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]-4-oxidanylidene-butanamide Openeye Name: N-(2,3-dimethylphenyl)-4-[2-[(3-ethoxy-5-iodo-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazino]-4-oxo-butanamide CAS Name: N-(2,3-dimethylphenyl)-4-[(3-ethoxy-5-iodo-4-oxo-1-cyclohexa-2,5-dienylidene)methylhydrazo]-4-oxobutanamide IUPAC Name: N-(2,3-dimethylphenyl)-4-[2-[(3-ethoxy-5-iodo-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]-4-oxobutanamide Traditional Name: N-(2,3-dimethylphenyl)-4-[N'-[(3-ethoxy-5-iodo-4-keto-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazino]-4-keto-butyramide Formula: C21H24IN3O4 MolecularWeight: 509.33743

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CNNC(=O)CCC(=O)NC2=CC=CC(=C2C)C)C=C(C1=O)I

Isomeric SMILES

CCOC1=CC(=CNNC(=O)CCC(=O)NC2=CC=CC(=C2C)C)C=C(C1=O)I

InChI

InChI=1S/C21H24IN3O4/c1-4-29-18-11-15(10-16(22)21(18)28)12-23-25-20(27)9-8-19(26)24-17-7-5-6-13(2)14(17)3/h5-7,10-12,23H,4,8-9H2,1-3H3,(H,24,26)(H,25,27)