N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-(3-oxidanylidene-1H-2-benzofuran-1-yl)ethanamide

Systemtic Name: N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-(3-oxidanylidene-1H-2-benzofuran-1-yl)ethanamide Openeye Name: N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-(3-oxo-1H-isobenzofuran-1-yl)acetamide CAS Name: N-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-2-(3-oxo-1H-isobenzofuran-1-yl)acetamide IUPAC Name: N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-2-(3-oxo-1H-2-benzofuran-1-yl)acetamide Traditional Name: N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-phthalidyl-acetamide Formula: C21H19N3O3 MolecularWeight: 361.39386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)CC3C4=CC=CC=C4C(=O)O3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)CC3C4=CC=CC=C4C(=O)O3

InChI

InChI=1S/C21H19N3O3/c1-13-20(14(2)24(23-13)15-8-4-3-5-9-15)22-19(25)12-18-16-10-6-7-11-17(16)21(26)27-18/h3-11,18H,12H2,1-2H3,(H,22,25)