[4-(2,2-dicyanoethenyl)-2-methoxy-phenyl] 3-bromanylbenzoate

Systemtic Name: [4-(2,2-dicyanoethenyl)-2-methoxy-phenyl] 3-bromanylbenzoate Openeye Name: [4-(2,2-dicyanovinyl)-2-methoxy-phenyl] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [4-(2,2-dicyanoethenyl)-2-methoxyphenyl] ester IUPAC Name: [4-(2,2-dicyanoethenyl)-2-methoxyphenyl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [4-(2,2-dicyanovinyl)-2-methoxy-phenyl] ester Formula: C18H11BrN2O3 MolecularWeight: 383.19554

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H11BrN2O3/c1-23-17-8-12(7-13(10-20)11-21)5-6-16(17)24-18(22)14-3-2-4-15(19)9-14/h2-9H,1H3