5-[3-[(4-methoxyphenyl)amino]-3-oxidanylidene-propyl]-1-phenyl-pyrazole-4-carboxylic acid

Systemtic Name: 5-[3-[(4-methoxyphenyl)amino]-3-oxidanylidene-propyl]-1-phenyl-pyrazole-4-carboxylic acid Openeye Name: 5-[3-(4-methoxyanilino)-3-oxo-propyl]-1-phenyl-pyrazole-4-carboxylic acid CAS Name: 5-[3-(4-methoxyanilino)-3-oxopropyl]-1-phenyl-4-pyrazolecarboxylic acid IUPAC Name: 5-[3-(4-methoxyanilino)-3-oxopropyl]-1-phenylpyrazole-4-carboxylic acid Traditional Name: 5-[3-keto-3-(p-anisidino)propyl]-1-phenyl-pyrazole-4-carboxylic acid Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)CCC2=C(C=NN2C3=CC=CC=C3)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)CCC2=C(C=NN2C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C20H19N3O4/c1-27-16-9-7-14(8-10-16)22-19(24)12-11-18-17(20(25)26)13-21-23(18)15-5-3-2-4-6-15/h2-10,13H,11-12H2,1H3,(H,22,24)(H,25,26)