(4-chlorophenyl)methyl 3-methyl-4-oxidanyl-1-benzofuran-2-carboxylate

Systemtic Name: (4-chlorophenyl)methyl 3-methyl-4-oxidanyl-1-benzofuran-2-carboxylate Openeye Name: (4-chlorophenyl)methyl 4-hydroxy-3-methyl-benzofuran-2-carboxylate CAS Name: 4-hydroxy-3-methyl-2-benzofurancarboxylic acid (4-chlorophenyl)methyl ester IUPAC Name: (4-chlorophenyl)methyl 4-hydroxy-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 4-hydroxy-3-methyl-coumarilic acid (4-chlorobenzyl) ester Formula: C17H13ClO4 MolecularWeight: 316.73572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=CC=C2)O)C(=O)OCC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(OC2=C1C(=CC=C2)O)C(=O)OCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H13ClO4/c1-10-15-13(19)3-2-4-14(15)22-16(10)17(20)21-9-11-5-7-12(18)8-6-11/h2-8,19H,9H2,1H3