[4-(2,2-dicyanoethenyl)-2-iodanyl-6-methoxy-phenyl] benzoate

Systemtic Name: [4-(2,2-dicyanoethenyl)-2-iodanyl-6-methoxy-phenyl] benzoate Openeye Name: [4-(2,2-dicyanovinyl)-2-iodo-6-methoxy-phenyl] benzoate CAS Name: benzoic acid [4-(2,2-dicyanoethenyl)-2-iodo-6-methoxyphenyl] ester IUPAC Name: [4-(2,2-dicyanoethenyl)-2-iodo-6-methoxyphenyl] benzoate Traditional Name: benzoic acid [4-(2,2-dicyanovinyl)-2-iodo-6-methoxy-phenyl] ester Formula: C18H11IN2O3 MolecularWeight: 430.19601

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C(C#N)C#N)I)OC(=O)C2=CC=CC=C2

Isomeric SMILES

COC1=C(C(=CC(=C1)C=C(C#N)C#N)I)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H11IN2O3/c1-23-16-9-12(7-13(10-20)11-21)8-15(19)17(16)24-18(22)14-5-3-2-4-6-14/h2-9H,1H3