ethyl 2-[4-(1,3-benzodioxol-5-ylcarbonylamino)-3,5-dimethyl-pyrazol-1-yl]ethanoate

Systemtic Name: ethyl 2-[4-(1,3-benzodioxol-5-ylcarbonylamino)-3,5-dimethyl-pyrazol-1-yl]ethanoate Openeye Name: ethyl 2-[4-(1,3-benzodioxole-5-carbonylamino)-3,5-dimethyl-pyrazol-1-yl]acetate CAS Name: 2-[4-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-3,5-dimethyl-1-pyrazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(1,3-benzodioxole-5-carbonylamino)-3,5-dimethylpyrazol-1-yl]acetate Traditional Name: 2-[3,5-dimethyl-4-(piperonyloylamino)pyrazol-1-yl]acetic acid ethyl ester Formula: C17H19N3O5 MolecularWeight: 345.34986

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(=C(C(=N1)C)NC(=O)C2=CC3=C(C=C2)OCO3)C

Isomeric SMILES

CCOC(=O)CN1C(=C(C(=N1)C)NC(=O)C2=CC3=C(C=C2)OCO3)C

InChI

InChI=1S/C17H19N3O5/c1-4-23-15(21)8-20-11(3)16(10(2)19-20)18-17(22)12-5-6-13-14(7-12)25-9-24-13/h5-7H,4,8-9H2,1-3H3,(H,18,22)