methyl 5-chloranyl-5-cyano-2-methyl-6,7-dihydro-4H-1-benzofuran-3-carboxylate

Systemtic Name: methyl 5-chloranyl-5-cyano-2-methyl-6,7-dihydro-4H-1-benzofuran-3-carboxylate Openeye Name: methyl 5-chloro-5-cyano-2-methyl-6,7-dihydro-4H-benzofuran-3-carboxylate CAS Name: 5-chloro-5-cyano-2-methyl-6,7-dihydro-4H-benzofuran-3-carboxylic acid methyl ester IUPAC Name: methyl 5-chloro-5-cyano-2-methyl-6,7-dihydro-4H-1-benzofuran-3-carboxylate Traditional Name: 5-chloro-5-cyano-2-methyl-6,7-dihydro-4H-benzofuran-3-carboxylic acid methyl ester Formula: C12H12ClNO3 MolecularWeight: 253.68158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)CCC(C2)(C#N)Cl)C(=O)OC

Isomeric SMILES

CC1=C(C2=C(O1)CCC(C2)(C#N)Cl)C(=O)OC

InChI

InChI=1S/C12H12ClNO3/c1-7-10(11(15)16-2)8-5-12(13,6-14)4-3-9(8)17-7/h3-5H2,1-2H3