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

Systemtic Name: N-[(2S)-1-[2-[(3-ethoxy-5-iodanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]-3-methyl-1-oxidanylidene-butan-2-yl]-4-methyl-benzamide Openeye Name: N-[(1S)-1-[[(3-ethoxy-5-iodo-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]-2-methyl-propyl]-4-methyl-benzamide CAS Name: N-[(2S)-1-[(3-ethoxy-5-iodo-4-oxo-1-cyclohexa-2,5-dienylidene)methylhydrazo]-3-methyl-1-oxobutan-2-yl]-4-methylbenzamide IUPAC Name: N-[(2S)-1-[2-[(3-ethoxy-5-iodo-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]-3-methyl-1-oxobutan-2-yl]-4-methylbenzamide Traditional Name: N-[(1S)-1-[[(3-ethoxy-5-iodo-4-keto-cyclohexa-2,5-dien-1-ylidene)methylamino]carbamoyl]-2-methyl-propyl]-4-methyl-benzamide Formula: C22H26IN3O4 MolecularWeight: 523.36401

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC1=CC(=CNNC(=O)[C@H](C(C)C)NC(=O)C2=CC=C(C=C2)C)C=C(C1=O)I

InChI

InChI=1S/C22H26IN3O4/c1-5-30-18-11-15(10-17(23)20(18)27)12-24-26-22(29)19(13(2)3)25-21(28)16-8-6-14(4)7-9-16/h6-13,19,24H,5H2,1-4H3,(H,25,28)(H,26,29)/t19-/m0/s1