1-[1-oxidanylidene-1-[1-(4-propan-2-ylphenyl)propylamino]propan-2-yl]pyrazole-4-carboxylic acid

Systemtic Name: 1-[1-oxidanylidene-1-[1-(4-propan-2-ylphenyl)propylamino]propan-2-yl]pyrazole-4-carboxylic acid Openeye Name: 1-[2-[1-(4-isopropylphenyl)propylamino]-1-methyl-2-oxo-ethyl]pyrazole-4-carboxylic acid CAS Name: 1-[1-oxo-1-[1-(4-propan-2-ylphenyl)propylamino]propan-2-yl]-4-pyrazolecarboxylic acid IUPAC Name: 1-[1-oxo-1-[1-(4-propan-2-ylphenyl)propylamino]propan-2-yl]pyrazole-4-carboxylic acid Traditional Name: 1-[2-keto-1-methyl-2-(1-p-cumenylpropylamino)ethyl]pyrazole-4-carboxylic acid Formula: C19H25N3O3 MolecularWeight: 343.4201

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)C(C)C)NC(=O)C(C)N2C=C(C=N2)C(=O)O

Isomeric SMILES

CCC(C1=CC=C(C=C1)C(C)C)NC(=O)C(C)N2C=C(C=N2)C(=O)O

InChI

InChI=1S/C19H25N3O3/c1-5-17(15-8-6-14(7-9-15)12(2)3)21-18(23)13(4)22-11-16(10-20-22)19(24)25/h6-13,17H,5H2,1-4H3,(H,21,23)(H,24,25)