2-[3-oxidanylidene-3-[(4-propan-2-ylphenyl)amino]propyl]pyrazole-3-carboxylic acid

Systemtic Name: 2-[3-oxidanylidene-3-[(4-propan-2-ylphenyl)amino]propyl]pyrazole-3-carboxylic acid Openeye Name: 2-[3-(4-isopropylanilino)-3-oxo-propyl]pyrazole-3-carboxylic acid CAS Name: 2-[3-oxo-3-(4-propan-2-ylanilino)propyl]-3-pyrazolecarboxylic acid IUPAC Name: 2-[3-oxo-3-(4-propan-2-ylanilino)propyl]pyrazole-3-carboxylic acid Traditional Name: 2-(3-cumidino-3-keto-propyl)pyrazole-3-carboxylic acid Formula: C16H19N3O3 MolecularWeight: 301.34036

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19N3O3/c1-11(2)12-3-5-13(6-4-12)18-15(20)8-10-19-14(16(21)22)7-9-17-19/h3-7,9,11H,8,10H2,1-2H3,(H,18,20)(H,21,22)