1-oxidanylidene-3-phenyl-N-(2-propan-2-ylpyrazol-3-yl)-3,4-dihydroisochromene-6-carboxamide

Systemtic Name: 1-oxidanylidene-3-phenyl-N-(2-propan-2-ylpyrazol-3-yl)-3,4-dihydroisochromene-6-carboxamide Openeye Name: N-(2-isopropylpyrazol-3-yl)-1-oxo-3-phenyl-isochromane-6-carboxamide CAS Name: 1-oxo-3-phenyl-N-(2-propan-2-yl-3-pyrazolyl)-3,4-dihydro-1H-2-benzopyran-6-carboxamide IUPAC Name: 1-oxo-3-phenyl-N-(2-propan-2-ylpyrazol-3-yl)-3,4-dihydroisochromene-6-carboxamide Traditional Name: N-(2-isopropylpyrazol-3-yl)-1-keto-3-phenyl-isochroman-6-carboxamide Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=CC=N1)NC(=O)C2=CC3=C(C=C2)C(=O)OC(C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)N1C(=CC=N1)NC(=O)C2=CC3=C(C=C2)C(=O)OC(C3)C4=CC=CC=C4

InChI

InChI=1S/C22H21N3O3/c1-14(2)25-20(10-11-23-25)24-21(26)16-8-9-18-17(12-16)13-19(28-22(18)27)15-6-4-3-5-7-15/h3-12,14,19H,13H2,1-2H3,(H,24,26)