(2R)-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2,3-dihydro-1-benzofuran-2-carboxamide

Systemtic Name: (2R)-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2,3-dihydro-1-benzofuran-2-carboxamide Openeye Name: (2R)-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2,3-dihydrobenzofuran-2-carboxamide CAS Name: (2R)-N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-2,3-dihydrobenzofuran-2-carboxamide IUPAC Name: (2R)-N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-2,3-dihydro-1-benzofuran-2-carboxamide Traditional Name: (2R)-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]coumaran-2-carboxamide Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)C3CC4=CC=CC=C4O3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)[C@H]3CC4=CC=CC=C4O3

InChI

InChI=1S/C21H21N3O2/c1-14-18(15(2)24(23-14)17-9-4-3-5-10-17)13-22-21(25)20-12-16-8-6-7-11-19(16)26-20/h3-11,20H,12-13H2,1-2H3,(H,22,25)/t20-/m1/s1