methyl 6-chloranyl-7-methyl-5-thiophen-2-ylcarbonyl-2,3-dihydro-1-benzofuran-2-carboxylate

Systemtic Name: methyl 6-chloranyl-7-methyl-5-thiophen-2-ylcarbonyl-2,3-dihydro-1-benzofuran-2-carboxylate Openeye Name: methyl 6-chloro-7-methyl-5-(thiophene-2-carbonyl)-2,3-dihydrobenzofuran-2-carboxylate CAS Name: 6-chloro-7-methyl-5-[oxo(thiophen-2-yl)methyl]-2,3-dihydrobenzofuran-2-carboxylic acid methyl ester IUPAC Name: methyl 6-chloro-7-methyl-5-(thiophene-2-carbonyl)-2,3-dihydro-1-benzofuran-2-carboxylate Traditional Name: 6-chloro-7-methyl-5-(2-thenoyl)coumaran-2-carboxylic acid methyl ester Formula: C16H13ClO4S MolecularWeight: 336.79002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC2=C1OC(C2)C(=O)OC)C(=O)C3=CC=CS3)Cl

Isomeric SMILES

CC1=C(C(=CC2=C1OC(C2)C(=O)OC)C(=O)C3=CC=CS3)Cl

InChI

InChI=1S/C16H13ClO4S/c1-8-13(17)10(14(18)12-4-3-5-22-12)6-9-7-11(16(19)20-2)21-15(8)9/h3-6,11H,7H2,1-2H3