2-(3,4-dichlorophenyl)-4-[(3-ethoxy-5-iodanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-5-methyl-1H-pyrazol-3-one

Systemtic Name: 2-(3,4-dichlorophenyl)-4-[(3-ethoxy-5-iodanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-5-methyl-1H-pyrazol-3-one Openeye Name: 2-(3,4-dichlorophenyl)-4-[(3-ethoxy-5-iodo-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]-5-methyl-1H-pyrazol-3-one CAS Name: 2-(3,4-dichlorophenyl)-4-[(3-ethoxy-5-iodo-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-5-methyl-1H-pyrazol-3-one IUPAC Name: 2-(3,4-dichlorophenyl)-4-[(3-ethoxy-5-iodo-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-5-methyl-1H-pyrazol-3-one Traditional Name: 2-(3,4-dichlorophenyl)-4-[(3-ethoxy-5-iodo-4-keto-cyclohexa-2,5-dien-1-ylidene)methyl]-5-methyl-3-pyrazolin-3-one Formula: C19H15Cl2IN2O3 MolecularWeight: 517.14447

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC2=C(NN(C2=O)C3=CC(=C(C=C3)Cl)Cl)C)C=C(C1=O)I

Isomeric SMILES

CCOC1=CC(=CC2=C(NN(C2=O)C3=CC(=C(C=C3)Cl)Cl)C)C=C(C1=O)I

InChI

InChI=1S/C19H15Cl2IN2O3/c1-3-27-17-8-11(7-16(22)18(17)25)6-13-10(2)23-24(19(13)26)12-4-5-14(20)15(21)9-12/h4-9,23H,3H2,1-2H3