N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[5-tert-butyl-2-(4-methoxyphenyl)-3-pyrazolyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]-piperonylamide Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)C2=CC3=C(C=C2)OCO3)C4=CC=C(C=C4)OC

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)C2=CC3=C(C=C2)OCO3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C22H23N3O4/c1-22(2,3)19-12-20(25(24-19)15-6-8-16(27-4)9-7-15)23-21(26)14-5-10-17-18(11-14)29-13-28-17/h5-12H,13H2,1-4H3,(H,23,26)