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

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-1-ethyl-N-prop-2-ynyl-pyrazole-3-carboxamide Openeye Name: 5-(1,3-benzodioxol-5-yl)-1-ethyl-N-prop-2-ynyl-pyrazole-3-carboxamide CAS Name: 5-(1,3-benzodioxol-5-yl)-1-ethyl-N-prop-2-ynyl-3-pyrazolecarboxamide IUPAC Name: 5-(1,3-benzodioxol-5-yl)-1-ethyl-N-prop-2-ynylpyrazole-3-carboxamide Traditional Name: 5-(1,3-benzodioxol-5-yl)-1-ethyl-N-propargyl-pyrazole-3-carboxamide Formula: C16H15N3O3 MolecularWeight: 297.3086

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=N1)C(=O)NCC#C)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCN1C(=CC(=N1)C(=O)NCC#C)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H15N3O3/c1-3-7-17-16(20)12-9-13(19(4-2)18-12)11-5-6-14-15(8-11)22-10-21-14/h1,5-6,8-9H,4,7,10H2,2H3,(H,17,20)