5-cyclopropyl-N-(6-ethanoyl-1,3-benzodioxol-5-yl)-2-phenyl-pyrazole-3-carboxamide

Systemtic Name: 5-cyclopropyl-N-(6-ethanoyl-1,3-benzodioxol-5-yl)-2-phenyl-pyrazole-3-carboxamide Openeye Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-5-cyclopropyl-2-phenyl-pyrazole-3-carboxamide CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-5-cyclopropyl-2-phenyl-3-pyrazolecarboxamide IUPAC Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-5-cyclopropyl-2-phenylpyrazole-3-carboxamide Traditional Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-5-cyclopropyl-2-phenyl-pyrazole-3-carboxamide Formula: C22H19N3O4 MolecularWeight: 389.40396

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NC(=O)C3=CC(=NN3C4=CC=CC=C4)C5CC5)OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NC(=O)C3=CC(=NN3C4=CC=CC=C4)C5CC5)OCO2

InChI

InChI=1S/C22H19N3O4/c1-13(26)16-9-20-21(29-12-28-20)11-18(16)23-22(27)19-10-17(14-7-8-14)24-25(19)15-5-3-2-4-6-15/h2-6,9-11,14H,7-8,12H2,1H3,(H,23,27)