methyl 4-[4-(1,3-benzodioxol-5-ylcarbonylamino)-3,5-dimethyl-pyrazol-1-yl]butanoate

Systemtic Name: methyl 4-[4-(1,3-benzodioxol-5-ylcarbonylamino)-3,5-dimethyl-pyrazol-1-yl]butanoate Openeye Name: methyl 4-[4-(1,3-benzodioxole-5-carbonylamino)-3,5-dimethyl-pyrazol-1-yl]butanoate CAS Name: 4-[4-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-3,5-dimethyl-1-pyrazolyl]butanoic acid methyl ester IUPAC Name: methyl 4-[4-(1,3-benzodioxole-5-carbonylamino)-3,5-dimethylpyrazol-1-yl]butanoate Traditional Name: 4-[3,5-dimethyl-4-(piperonyloylamino)pyrazol-1-yl]butyric acid methyl ester Formula: C18H21N3O5 MolecularWeight: 359.37644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCCC(=O)OC)C)NC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=C(C(=NN1CCCC(=O)OC)C)NC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H21N3O5/c1-11-17(12(2)21(20-11)8-4-5-16(22)24-3)19-18(23)13-6-7-14-15(9-13)26-10-25-14/h6-7,9H,4-5,8,10H2,1-3H3,(H,19,23)