N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-3,5-dimethyl-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-3,5-dimethyl-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-(2,3-dihydrobenzofuran-2-ylmethyl)-3,5-dimethyl-1-phenyl-pyrazole-4-carboxamide CAS Name: N-(2,3-dihydrobenzofuran-2-ylmethyl)-3,5-dimethyl-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-3,5-dimethyl-1-phenylpyrazole-4-carboxamide Traditional Name: N-(coumaran-2-ylmethyl)-3,5-dimethyl-1-phenyl-pyrazole-4-carboxamide Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)NCC3CC4=CC=CC=C4O3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)NCC3CC4=CC=CC=C4O3

InChI

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