5-[2-(dimethylamino)-2-oxidanylidene-ethoxy]-1-phenyl-pyrazole-4-carboxylic acid

Systemtic Name: 5-[2-(dimethylamino)-2-oxidanylidene-ethoxy]-1-phenyl-pyrazole-4-carboxylic acid Openeye Name: 5-[2-(dimethylamino)-2-oxo-ethoxy]-1-phenyl-pyrazole-4-carboxylic acid CAS Name: 5-[2-(dimethylamino)-2-oxoethoxy]-1-phenyl-4-pyrazolecarboxylic acid IUPAC Name: 5-[2-(dimethylamino)-2-oxoethoxy]-1-phenylpyrazole-4-carboxylic acid Traditional Name: 5-[2-(dimethylamino)-2-keto-ethoxy]-1-phenyl-pyrazole-4-carboxylic acid Formula: C14H15N3O4 MolecularWeight: 289.2866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)COC1=C(C=NN1C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CN(C)C(=O)COC1=C(C=NN1C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C14H15N3O4/c1-16(2)12(18)9-21-13-11(14(19)20)8-15-17(13)10-6-4-3-5-7-10/h3-8H,9H2,1-2H3,(H,19,20)