ethyl 3-[4-(1,3-benzothiazol-2-yl)butanoyloxymethyl]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-[4-(1,3-benzothiazol-2-yl)butanoyloxymethyl]-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-[4-(1,3-benzothiazol-2-yl)butanoyloxymethyl]benzofuran-2-carboxylate CAS Name: 3-[[4-(1,3-benzothiazol-2-yl)-1-oxobutoxy]methyl]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-[4-(1,3-benzothiazol-2-yl)butanoyloxymethyl]-1-benzofuran-2-carboxylate Traditional Name: 3-[4-(1,3-benzothiazol-2-yl)butanoyloxymethyl]coumarilic acid ethyl ester Formula: C23H21NO5S MolecularWeight: 423.48154

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2O1)COC(=O)CCCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)COC(=O)CCCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H21NO5S/c1-2-27-23(26)22-16(15-8-3-5-10-18(15)29-22)14-28-21(25)13-7-12-20-24-17-9-4-6-11-19(17)30-20/h3-6,8-11H,2,7,12-14H2,1H3