(4-cyanophenyl)methyl (2R)-5-chloranyl-2,3-dihydro-1-benzofuran-2-carboxylate

Systemtic Name: (4-cyanophenyl)methyl (2R)-5-chloranyl-2,3-dihydro-1-benzofuran-2-carboxylate Openeye Name: (4-cyanophenyl)methyl (2R)-5-chloro-2,3-dihydrobenzofuran-2-carboxylate CAS Name: (2R)-5-chloro-2,3-dihydrobenzofuran-2-carboxylic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl (2R)-5-chloro-2,3-dihydro-1-benzofuran-2-carboxylate Traditional Name: (2R)-5-chlorocoumaran-2-carboxylic acid (4-cyanobenzyl) ester Formula: C17H12ClNO3 MolecularWeight: 313.73508

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C1C=C(C=C2)Cl)C(=O)OCC3=CC=C(C=C3)C#N

Isomeric SMILES

C1[C@@H](OC2=C1C=C(C=C2)Cl)C(=O)OCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H12ClNO3/c18-14-5-6-15-13(7-14)8-16(22-15)17(20)21-10-12-3-1-11(9-19)2-4-12/h1-7,16H,8,10H2/t16-/m1/s1