3-methyl-2-[(4-pyrazol-1-ylphenyl)carbonylamino]butanoic acid

Systemtic Name: 3-methyl-2-[(4-pyrazol-1-ylphenyl)carbonylamino]butanoic acid Openeye Name: 3-methyl-2-[(4-pyrazol-1-ylbenzoyl)amino]butanoic acid CAS Name: 3-methyl-2-[[oxo-[4-(1-pyrazolyl)phenyl]methyl]amino]butanoic acid IUPAC Name: 3-methyl-2-[(4-pyrazol-1-ylbenzoyl)amino]butanoic acid Traditional Name: 3-methyl-2-[(4-pyrazol-1-ylbenzoyl)amino]butyric acid Formula: C15H17N3O3 MolecularWeight: 287.31378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17N3O3/c1-10(2)13(15(20)21)17-14(19)11-4-6-12(7-5-11)18-9-3-8-16-18/h3-10,13H,1-2H3,(H,17,19)(H,20,21)