4-(dimethylamino)-2-methyl-5-phenyl-pyrazole-3-carboxylic acid

Systemtic Name: 4-(dimethylamino)-2-methyl-5-phenyl-pyrazole-3-carboxylic acid Openeye Name: 4-(dimethylamino)-2-methyl-5-phenyl-pyrazole-3-carboxylic acid CAS Name: 4-(dimethylamino)-2-methyl-5-phenyl-3-pyrazolecarboxylic acid IUPAC Name: 4-(dimethylamino)-2-methyl-5-phenylpyrazole-3-carboxylic acid Traditional Name: 4-(dimethylamino)-2-methyl-5-phenyl-pyrazole-3-carboxylic acid Formula: C13H15N3O2 MolecularWeight: 245.2771

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C2=CC=CC=C2)N(C)C)C(=O)O

Isomeric SMILES

CN1C(=C(C(=N1)C2=CC=CC=C2)N(C)C)C(=O)O

InChI

InChI=1S/C13H15N3O2/c1-15(2)11-10(9-7-5-4-6-8-9)14-16(3)12(11)13(17)18/h4-8H,1-3H3,(H,17,18)