4-(2-propylpyrazol-3-yl)carbonyl-1,3-benzodioxole-2-carboxylic acid

Systemtic Name: 4-(2-propylpyrazol-3-yl)carbonyl-1,3-benzodioxole-2-carboxylic acid Openeye Name: 4-(2-propylpyrazole-3-carbonyl)-1,3-benzodioxole-2-carboxylic acid CAS Name: 4-[oxo-(2-propyl-3-pyrazolyl)methyl]-1,3-benzodioxole-2-carboxylic acid IUPAC Name: 4-(2-propylpyrazole-3-carbonyl)-1,3-benzodioxole-2-carboxylic acid Traditional Name: 4-(2-propylpyrazole-3-carbonyl)-1,3-benzodioxole-2-carboxylic acid Formula: C15H14N2O5 MolecularWeight: 302.28206

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC=N1)C(=O)C2=C3C(=CC=C2)OC(O3)C(=O)O

Isomeric SMILES

CCCN1C(=CC=N1)C(=O)C2=C3C(=CC=C2)OC(O3)C(=O)O

InChI

InChI=1S/C15H14N2O5/c1-2-8-17-10(6-7-16-17)12(18)9-4-3-5-11-13(9)22-15(21-11)14(19)20/h3-7,15H,2,8H2,1H3,(H,19,20)