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

Systemtic Name: 2-[3-oxidanylidene-3-[phenyl-(phenylmethyl)amino]propyl]pyrazole-3-carboxylic acid Openeye Name: 2-[3-(N-benzylanilino)-3-oxo-propyl]pyrazole-3-carboxylic acid CAS Name: 2-[3-oxo-3-(N-(phenylmethyl)anilino)propyl]-3-pyrazolecarboxylic acid IUPAC Name: 2-[3-(N-benzylanilino)-3-oxopropyl]pyrazole-3-carboxylic acid Traditional Name: 2-[3-(N-benzylanilino)-3-keto-propyl]pyrazole-3-carboxylic acid Formula: C20H19N3O3 MolecularWeight: 349.38316

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(C2=CC=CC=C2)C(=O)CCN3C(=CC=N3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN(C2=CC=CC=C2)C(=O)CCN3C(=CC=N3)C(=O)O

InChI

InChI=1S/C20H19N3O3/c24-19(12-14-23-18(20(25)26)11-13-21-23)22(17-9-5-2-6-10-17)15-16-7-3-1-4-8-16/h1-11,13H,12,14-15H2,(H,25,26)