N-[4-[[(E)-(5-ethoxy-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]-4-iodanyl-benzamide

Systemtic Name: N-[4-[[(E)-(5-ethoxy-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]-4-iodanyl-benzamide Openeye Name: N-[4-[[(E)-(5-ethoxy-3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]-4-iodo-benzamide CAS Name: N-[4-[[(E)-(5-ethoxy-3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]phenyl]-4-iodobenzamide IUPAC Name: N-[4-[[(E)-(5-ethoxy-3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]-4-iodobenzamide Traditional Name: N-[4-[[(E)-(5-ethoxy-6-keto-3-nitro-cyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]-4-iodo-benzamide Formula: C22H18IN3O5 MolecularWeight: 531.29989

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=CNC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)I)C1=O)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C/C(=C\NC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)I)/C1=O)[N+](=O)[O-]

InChI

InChI=1S/C22H18IN3O5/c1-2-31-20-12-19(26(29)30)11-15(21(20)27)13-24-17-7-9-18(10-8-17)25-22(28)14-3-5-16(23)6-4-14/h3-13,24H,2H2,1H3,(H,25,28)/b15-13+