3-methyl-2-[(1-methyl-5-pyrrol-1-yl-pyrazol-4-yl)carbonylamino]butanoic acid

Systemtic Name: 3-methyl-2-[(1-methyl-5-pyrrol-1-yl-pyrazol-4-yl)carbonylamino]butanoic acid Openeye Name: 3-methyl-2-[(1-methyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)amino]butanoic acid CAS Name: 3-methyl-2-[[[1-methyl-5-(1-pyrrolyl)-4-pyrazolyl]-oxomethyl]amino]butanoic acid IUPAC Name: 3-methyl-2-[(1-methyl-5-pyrrol-1-ylpyrazole-4-carbonyl)amino]butanoic acid Traditional Name: 3-methyl-2-[(1-methyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)amino]butyric acid Formula: C14H18N4O3 MolecularWeight: 290.31772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)C1=C(N(N=C1)C)N2C=CC=C2

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)C1=C(N(N=C1)C)N2C=CC=C2

InChI

InChI=1S/C14H18N4O3/c1-9(2)11(14(20)21)16-12(19)10-8-15-17(3)13(10)18-6-4-5-7-18/h4-9,11H,1-3H3,(H,16,19)(H,20,21)