(1-cyanoindolizin-2-yl)methyl 2,3,6-tris(chloranyl)benzoate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 2,3,6-tris(chloranyl)benzoate Openeye Name: (1-cyanoindolizin-2-yl)methyl 2,3,6-trichlorobenzoate CAS Name: 2,3,6-trichlorobenzoic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 2,3,6-trichlorobenzoate Traditional Name: 2,3,6-trichlorobenzoic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C17H9Cl3N2O2 MolecularWeight: 379.62456

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=CN2C=C1)COC(=O)C3=C(C=CC(=C3Cl)Cl)Cl)C#N

Isomeric SMILES

C1=CC2=C(C(=CN2C=C1)COC(=O)C3=C(C=CC(=C3Cl)Cl)Cl)C#N

InChI

InChI=1S/C17H9Cl3N2O2/c18-12-4-5-13(19)16(20)15(12)17(23)24-9-10-8-22-6-2-1-3-14(22)11(10)7-21/h1-6,8H,9H2