methyl 2-(1-phenylsulfanylpropan-2-yl)-2,3-dihydro-1-benzofuran-6-carboxylate

Systemtic Name: methyl 2-(1-phenylsulfanylpropan-2-yl)-2,3-dihydro-1-benzofuran-6-carboxylate Openeye Name: methyl 2-(1-methyl-2-phenylsulfanyl-ethyl)-2,3-dihydrobenzofuran-6-carboxylate CAS Name: 2-[1-(phenylthio)propan-2-yl]-2,3-dihydrobenzofuran-6-carboxylic acid methyl ester IUPAC Name: methyl 2-(1-phenylsulfanylpropan-2-yl)-2,3-dihydro-1-benzofuran-6-carboxylate Traditional Name: 2-[1-methyl-2-(phenylthio)ethyl]coumaran-6-carboxylic acid methyl ester Formula: C19H20O3S MolecularWeight: 328.4253

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC1=CC=CC=C1)C2CC3=C(O2)C=C(C=C3)C(=O)OC

Isomeric SMILES

CC(CSC1=CC=CC=C1)C2CC3=C(O2)C=C(C=C3)C(=O)OC

InChI

InChI=1S/C19H20O3S/c1-13(12-23-16-6-4-3-5-7-16)17-10-14-8-9-15(19(20)21-2)11-18(14)22-17/h3-9,11,13,17H,10,12H2,1-2H3