methyl 3-(1-deuterioethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-carboxylate

Systemtic Name: methyl 3-(1-deuterioethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-carboxylate Openeye Name: methyl 3-(1-deuterioethyl)-7-methoxy-2,3-dihydrobenzofuran-5-carboxylate CAS Name: 3-(1-deuterioethyl)-7-methoxy-2,3-dihydrobenzofuran-5-carboxylic acid methyl ester IUPAC Name: methyl 3-(1-deuterioethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-carboxylate Traditional Name: 3-(1-deuterioethyl)-7-methoxy-coumaran-5-carboxylic acid methyl ester Formula: C13H16O4 MolecularWeight: 237.269902

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Descriptors Computed from Structure

Canonical SMILES:

CCC1COC2=C1C=C(C=C2OC)C(=O)OC

Isomeric SMILES

[2H]C(C)C1COC2=C1C=C(C=C2OC)C(=O)OC

InChI

InChI=1S/C13H16O4/c1-4-8-7-17-12-10(8)5-9(13(14)16-3)6-11(12)15-2/h5-6,8H,4,7H2,1-3H3/i4D