hex-5-enyl 5-(hydroxymethyl)-7-methoxy-2-(4-methylphenyl)-1-benzofuran-3-carboxylate

Systemtic Name: hex-5-enyl 5-(hydroxymethyl)-7-methoxy-2-(4-methylphenyl)-1-benzofuran-3-carboxylate Openeye Name: hex-5-enyl 5-(hydroxymethyl)-7-methoxy-2-(p-tolyl)benzofuran-3-carboxylate CAS Name: 5-(hydroxymethyl)-7-methoxy-2-(4-methylphenyl)-3-benzofurancarboxylic acid hex-5-enyl ester IUPAC Name: hex-5-enyl 5-(hydroxymethyl)-7-methoxy-2-(4-methylphenyl)-1-benzofuran-3-carboxylate Traditional Name: 7-methoxy-5-methylol-2-(p-tolyl)benzofuran-3-carboxylic acid hex-5-enyl ester Formula: C24H26O5 MolecularWeight: 394.46024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C3=CC(=CC(=C3O2)OC)CO)C(=O)OCCCCC=C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C3=CC(=CC(=C3O2)OC)CO)C(=O)OCCCCC=C

InChI

InChI=1S/C24H26O5/c1-4-5-6-7-12-28-24(26)21-19-13-17(15-25)14-20(27-3)23(19)29-22(21)18-10-8-16(2)9-11-18/h4,8-11,13-14,25H,1,5-7,12,15H2,2-3H3