(3-cyanophenyl) 5-methoxy-3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: (3-cyanophenyl) 5-methoxy-3-methyl-1-benzofuran-2-carboxylate Openeye Name: (3-cyanophenyl) 5-methoxy-3-methyl-benzofuran-2-carboxylate CAS Name: 5-methoxy-3-methyl-2-benzofurancarboxylic acid (3-cyanophenyl) ester IUPAC Name: (3-cyanophenyl) 5-methoxy-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 5-methoxy-3-methyl-coumarilic acid (3-cyanophenyl) ester Formula: C18H13NO4 MolecularWeight: 307.30012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)OC)C(=O)OC3=CC=CC(=C3)C#N

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)OC)C(=O)OC3=CC=CC(=C3)C#N

InChI

InChI=1S/C18H13NO4/c1-11-15-9-13(21-2)6-7-16(15)23-17(11)18(20)22-14-5-3-4-12(8-14)10-19/h3-9H,1-2H3