5-[2,2-dimethyl-3-oxidanylidene-3-(propan-2-ylamino)propyl]-3-methyl-1-phenyl-pyrazole-4-carboxylic acid

Systemtic Name: 5-[2,2-dimethyl-3-oxidanylidene-3-(propan-2-ylamino)propyl]-3-methyl-1-phenyl-pyrazole-4-carboxylic acid Openeye Name: 5-[3-(isopropylamino)-2,2-dimethyl-3-oxo-propyl]-3-methyl-1-phenyl-pyrazole-4-carboxylic acid CAS Name: 5-[2,2-dimethyl-3-oxo-3-(propan-2-ylamino)propyl]-3-methyl-1-phenyl-4-pyrazolecarboxylic acid IUPAC Name: 5-[2,2-dimethyl-3-oxo-3-(propan-2-ylamino)propyl]-3-methyl-1-phenylpyrazole-4-carboxylic acid Traditional Name: 5-[3-(isopropylamino)-3-keto-2,2-dimethyl-propyl]-3-methyl-1-phenyl-pyrazole-4-carboxylic acid Formula: C19H25N3O3 MolecularWeight: 343.4201

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)O)CC(C)(C)C(=O)NC(C)C)C2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=C1C(=O)O)CC(C)(C)C(=O)NC(C)C)C2=CC=CC=C2

InChI

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