2-[4-bromanyl-2-(hydroxymethyl)phenoxy]-N-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]ethanamide

Systemtic Name: 2-[4-bromanyl-2-(hydroxymethyl)phenoxy]-N-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]ethanamide Openeye Name: 2-[4-bromo-2-(hydroxymethyl)phenoxy]-N-[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]acetamide CAS Name: 2-[4-bromo-2-(hydroxymethyl)phenoxy]-N-[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]acetamide IUPAC Name: 2-[4-bromo-2-(hydroxymethyl)phenoxy]-N-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]acetamide Traditional Name: 2-(4-bromo-2-methylol-phenoxy)-N-[(2S)-5-ethoxy-2-methyl-coumaran-6-yl]acetamide Formula: C20H22BrNO5 MolecularWeight: 436.29638

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)NC(=O)COC3=C(C=C(C=C3)Br)CO

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C[C@@H](O2)C)NC(=O)COC3=C(C=C(C=C3)Br)CO

InChI

InChI=1S/C20H22BrNO5/c1-3-25-19-8-13-6-12(2)27-18(13)9-16(19)22-20(24)11-26-17-5-4-15(21)7-14(17)10-23/h4-5,7-9,12,23H,3,6,10-11H2,1-2H3,(H,22,24)/t12-/m0/s1