2-[3-[(3-fluorophenyl)amino]-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid

Systemtic Name: 2-[3-[(3-fluorophenyl)amino]-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid Openeye Name: 2-[3-(3-fluoroanilino)-3-oxo-propyl]pyrazole-3-carboxylic acid CAS Name: 2-[3-(3-fluoroanilino)-3-oxopropyl]-3-pyrazolecarboxylic acid IUPAC Name: 2-[3-(3-fluoroanilino)-3-oxopropyl]pyrazole-3-carboxylic acid Traditional Name: 2-[3-(3-fluoroanilino)-3-keto-propyl]pyrazole-3-carboxylic acid Formula: C13H12FN3O3 MolecularWeight: 277.251083

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)NC(=O)CCN2C(=CC=N2)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)F)NC(=O)CCN2C(=CC=N2)C(=O)O

InChI

InChI=1S/C13H12FN3O3/c14-9-2-1-3-10(8-9)16-12(18)5-7-17-11(13(19)20)4-6-15-17/h1-4,6,8H,5,7H2,(H,16,18)(H,19,20)