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

Systemtic Name: 4-[4-(1,3-benzodioxol-5-ylcarbonylamino)pyrazol-1-yl]butanoate Openeye Name: 4-[4-(1,3-benzodioxole-5-carbonylamino)pyrazol-1-yl]butanoate CAS Name: 4-[4-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-1-pyrazolyl]butanoate IUPAC Name: 4-[4-(1,3-benzodioxole-5-carbonylamino)pyrazol-1-yl]butanoate Traditional Name: 4-[4-(piperonyloylamino)pyrazol-1-yl]butyrate Formula: C15H14N3O5- MolecularWeight: 316.28876

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=CN(N=C3)CCCC(=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=CN(N=C3)CCCC(=O)[O-]

InChI

InChI=1S/C15H15N3O5/c19-14(20)2-1-5-18-8-11(7-16-18)17-15(21)10-3-4-12-13(6-10)23-9-22-12/h3-4,6-8H,1-2,5,9H2,(H,17,21)(H,19,20)/p-1