1-(3-cyanophenyl)-5-cyclopropyl-pyrazole-4-carboxylic acid

Systemtic Name: 1-(3-cyanophenyl)-5-cyclopropyl-pyrazole-4-carboxylic acid Openeye Name: 1-(3-cyanophenyl)-5-cyclopropyl-pyrazole-4-carboxylic acid CAS Name: 1-(3-cyanophenyl)-5-cyclopropyl-4-pyrazolecarboxylic acid IUPAC Name: 1-(3-cyanophenyl)-5-cyclopropylpyrazole-4-carboxylic acid Traditional Name: 1-(3-cyanophenyl)-5-cyclopropyl-pyrazole-4-carboxylic acid Formula: C14H11N3O2 MolecularWeight: 253.25604

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=C(C=NN2C3=CC=CC(=C3)C#N)C(=O)O

Isomeric SMILES

C1CC1C2=C(C=NN2C3=CC=CC(=C3)C#N)C(=O)O

InChI

InChI=1S/C14H11N3O2/c15-7-9-2-1-3-11(6-9)17-13(10-4-5-10)12(8-16-17)14(18)19/h1-3,6,8,10H,4-5H2,(H,18,19)