5-[[5-(1,3-benzodioxol-5-yl)-5-methyl-2-oxidanylidene-oxolan-3-yl]amino]-1H-pyrazole-4-carboxylate

Systemtic Name: 5-[[5-(1,3-benzodioxol-5-yl)-5-methyl-2-oxidanylidene-oxolan-3-yl]amino]-1H-pyrazole-4-carboxylate Openeye Name: 5-[[5-(1,3-benzodioxol-5-yl)-5-methyl-2-oxo-tetrahydrofuran-3-yl]amino]-1H-pyrazole-4-carboxylate CAS Name: 5-[[5-(1,3-benzodioxol-5-yl)-5-methyl-2-oxo-3-oxolanyl]amino]-1H-pyrazole-4-carboxylate IUPAC Name: 5-[[5-(1,3-benzodioxol-5-yl)-5-methyl-2-oxooxolan-3-yl]amino]-1H-pyrazole-4-carboxylate Traditional Name: 5-[[5-(1,3-benzodioxol-5-yl)-2-keto-5-methyl-tetrahydrofuran-3-yl]amino]-1H-pyrazole-4-carboxylate Formula: C16H14N3O6- MolecularWeight: 344.29886

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C(=O)O1)NC2=C(C=NN2)C(=O)[O-])C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1(CC(C(=O)O1)NC2=C(C=NN2)C(=O)[O-])C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C16H15N3O6/c1-16(8-2-3-11-12(4-8)24-7-23-11)5-10(15(22)25-16)18-13-9(14(20)21)6-17-19-13/h2-4,6,10H,5,7H2,1H3,(H,20,21)(H2,17,18,19)/p-1