N-[[(2R)-5-chloranyl-7-pyrimidin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-2-(3-methoxyphenyl)ethanamide

Systemtic Name: N-[[(2R)-5-chloranyl-7-pyrimidin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-2-(3-methoxyphenyl)ethanamide Openeye Name: N-[[(2R)-5-chloro-7-pyrimidin-2-yl-2,3-dihydrobenzofuran-2-yl]methyl]-2-(3-methoxyphenyl)acetamide CAS Name: N-[[(2R)-5-chloro-7-(2-pyrimidinyl)-2,3-dihydrobenzofuran-2-yl]methyl]-2-(3-methoxyphenyl)acetamide IUPAC Name: N-[[(2R)-5-chloro-7-pyrimidin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-2-(3-methoxyphenyl)acetamide Traditional Name: N-[[(2R)-5-chloro-7-(2-pyrimidyl)coumaran-2-yl]methyl]-2-(3-methoxyphenyl)acetamide Formula: C22H20ClN3O3 MolecularWeight: 409.8655

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20ClN3O3/c1-28-17-5-2-4-14(8-17)9-20(27)26-13-18-11-15-10-16(23)12-19(21(15)29-18)22-24-6-3-7-25-22/h2-8,10,12,18H,9,11,13H2,1H3,(H,26,27)/t18-/m1/s1