5-oxidanylidene-5-[(1-phenylpyrazol-3-yl)amino]-2-propyl-pentanoic acid

Systemtic Name: 5-oxidanylidene-5-[(1-phenylpyrazol-3-yl)amino]-2-propyl-pentanoic acid Openeye Name: 5-oxo-5-[(1-phenylpyrazol-3-yl)amino]-2-propyl-pentanoic acid CAS Name: 5-oxo-5-[(1-phenyl-3-pyrazolyl)amino]-2-propylpentanoic acid IUPAC Name: 5-oxo-5-[(1-phenylpyrazol-3-yl)amino]-2-propylpentanoic acid Traditional Name: 5-keto-5-[(1-phenylpyrazol-3-yl)amino]-2-propyl-valeric acid Formula: C17H21N3O3 MolecularWeight: 315.36694

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC(=O)NC1=NN(C=C1)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCCC(CCC(=O)NC1=NN(C=C1)C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C17H21N3O3/c1-2-6-13(17(22)23)9-10-16(21)18-15-11-12-20(19-15)14-7-4-3-5-8-14/h3-5,7-8,11-13H,2,6,9-10H2,1H3,(H,22,23)(H,18,19,21)