methyl 2-cyanato-5-[(4-cyanato-3-methoxycarbonyl-phenyl)methyl]benzoate

Systemtic Name: methyl 2-cyanato-5-[(4-cyanato-3-methoxycarbonyl-phenyl)methyl]benzoate Openeye Name: methyl 2-cyanato-5-[(4-cyanato-3-methoxycarbonyl-phenyl)methyl]benzoate CAS Name: 2-cyanato-5-[(4-cyanato-3-methoxycarbonylphenyl)methyl]benzoic acid methyl ester IUPAC Name: methyl 2-cyanato-5-[(4-cyanato-3-methoxycarbonylphenyl)methyl]benzoate Traditional Name: 5-(3-carbomethoxy-4-cyanato-benzyl)-2-cyanato-benzoic acid methyl ester Formula: C19H14N2O6 MolecularWeight: 366.32426

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)CC2=CC(=C(C=C2)OC#N)C(=O)OC)OC#N

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)CC2=CC(=C(C=C2)OC#N)C(=O)OC)OC#N

InChI

InChI=1S/C19H14N2O6/c1-24-18(22)14-8-12(3-5-16(14)26-10-20)7-13-4-6-17(27-11-21)15(9-13)19(23)25-2/h3-6,8-9H,7H2,1-2H3