5-(1,3-benzodioxol-5-yl)-2-ethyl-N-phenethyl-pyrazole-3-carboxamide

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-2-ethyl-N-phenethyl-pyrazole-3-carboxamide Openeye Name: 5-(1,3-benzodioxol-5-yl)-2-ethyl-N-phenethyl-pyrazole-3-carboxamide CAS Name: 5-(1,3-benzodioxol-5-yl)-2-ethyl-N-phenethyl-3-pyrazolecarboxamide IUPAC Name: 5-(1,3-benzodioxol-5-yl)-2-ethyl-N-phenethylpyrazole-3-carboxamide Traditional Name: 5-(1,3-benzodioxol-5-yl)-2-ethyl-N-phenethyl-pyrazole-3-carboxamide Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=N1)C2=CC3=C(C=C2)OCO3)C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

CCN1C(=CC(=N1)C2=CC3=C(C=C2)OCO3)C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C21H21N3O3/c1-2-24-18(21(25)22-11-10-15-6-4-3-5-7-15)13-17(23-24)16-8-9-19-20(12-16)27-14-26-19/h3-9,12-13H,2,10-11,14H2,1H3,(H,22,25)