2-bromanyl-N-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl]-5-methoxy-benzamide

Systemtic Name: 2-bromanyl-N-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl]-5-methoxy-benzamide Openeye Name: 2-bromo-N-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methyl]-5-methoxy-benzamide CAS Name: 2-bromo-N-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methyl]-5-methoxybenzamide IUPAC Name: 2-bromo-N-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl]-5-methoxybenzamide Traditional Name: 2-bromo-N-[[(2S)-5-ethoxy-2-methyl-coumaran-6-yl]methyl]-5-methoxy-benzamide Formula: C20H22BrNO4 MolecularWeight: 420.29698

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)CNC(=O)C3=C(C=CC(=C3)OC)Br

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C[C@@H](O2)C)CNC(=O)C3=C(C=CC(=C3)OC)Br

InChI

InChI=1S/C20H22BrNO4/c1-4-25-18-8-13-7-12(2)26-19(13)9-14(18)11-22-20(23)16-10-15(24-3)5-6-17(16)21/h5-6,8-10,12H,4,7,11H2,1-3H3,(H,22,23)/t12-/m0/s1