N-[[7-chloranyl-5-(2,5-dimethoxyphenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]-2-methyl-pyrazole-3-carboxamide

Systemtic Name: N-[[7-chloranyl-5-(2,5-dimethoxyphenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]-2-methyl-pyrazole-3-carboxamide Openeye Name: N-[[7-chloro-5-(2,5-dimethoxyphenyl)-2,3-dihydrobenzofuran-2-yl]methyl]-2-methyl-pyrazole-3-carboxamide CAS Name: N-[[7-chloro-5-(2,5-dimethoxyphenyl)-2,3-dihydrobenzofuran-2-yl]methyl]-2-methyl-3-pyrazolecarboxamide IUPAC Name: N-[[7-chloro-5-(2,5-dimethoxyphenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]-2-methylpyrazole-3-carboxamide Traditional Name: N-[[7-chloro-5-(2,5-dimethoxyphenyl)coumaran-2-yl]methyl]-2-methyl-pyrazole-3-carboxamide Formula: C22H22ClN3O4 MolecularWeight: 427.88078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)C(=O)NCC2CC3=C(O2)C(=CC(=C3)C4=C(C=CC(=C4)OC)OC)Cl

Isomeric SMILES

CN1C(=CC=N1)C(=O)NCC2CC3=C(O2)C(=CC(=C3)C4=C(C=CC(=C4)OC)OC)Cl

InChI

InChI=1S/C22H22ClN3O4/c1-26-19(6-7-25-26)22(27)24-12-16-9-14-8-13(10-18(23)21(14)30-16)17-11-15(28-2)4-5-20(17)29-3/h4-8,10-11,16H,9,12H2,1-3H3,(H,24,27)