N-[[(2R)-5-chloranyl-7-pyrimidin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-2,4-dimethoxy-benzamide

Systemtic Name: N-[[(2R)-5-chloranyl-7-pyrimidin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-2,4-dimethoxy-benzamide Openeye Name: N-[[(2R)-5-chloro-7-pyrimidin-2-yl-2,3-dihydrobenzofuran-2-yl]methyl]-2,4-dimethoxy-benzamide CAS Name: N-[[(2R)-5-chloro-7-(2-pyrimidinyl)-2,3-dihydrobenzofuran-2-yl]methyl]-2,4-dimethoxybenzamide IUPAC Name: N-[[(2R)-5-chloro-7-pyrimidin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-2,4-dimethoxybenzamide Traditional Name: N-[[(2R)-5-chloro-7-(2-pyrimidyl)coumaran-2-yl]methyl]-2,4-dimethoxy-benzamide Formula: C22H20ClN3O4 MolecularWeight: 425.8649

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)NCC2CC3=C(O2)C(=CC(=C3)Cl)C4=NC=CC=N4)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)NC[C@H]2CC3=C(O2)C(=CC(=C3)Cl)C4=NC=CC=N4)OC

InChI

InChI=1S/C22H20ClN3O4/c1-28-15-4-5-17(19(11-15)29-2)22(27)26-12-16-9-13-8-14(23)10-18(20(13)30-16)21-24-6-3-7-25-21/h3-8,10-11,16H,9,12H2,1-2H3,(H,26,27)/t16-/m1/s1