4-(3-cyanopropoxy)-1-phenyl-pyrazole-3-carboxylic acid

Systemtic Name: 4-(3-cyanopropoxy)-1-phenyl-pyrazole-3-carboxylic acid Openeye Name: 4-(3-cyanopropoxy)-1-phenyl-pyrazole-3-carboxylic acid CAS Name: 4-(3-cyanopropoxy)-1-phenyl-3-pyrazolecarboxylic acid IUPAC Name: 4-(3-cyanopropoxy)-1-phenylpyrazole-3-carboxylic acid Traditional Name: 4-(3-cyanopropoxy)-1-phenyl-pyrazole-3-carboxylic acid Formula: C14H13N3O3 MolecularWeight: 271.27132

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C(=O)O)OCCCC#N

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C(=O)O)OCCCC#N

InChI

InChI=1S/C14H13N3O3/c15-8-4-5-9-20-12-10-17(16-13(12)14(18)19)11-6-2-1-3-7-11/h1-3,6-7,10H,4-5,9H2,(H,18,19)