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

Systemtic Name: 2-[(1-methyl-5-pyrrol-1-yl-pyrazol-4-yl)carbonylamino]-3-oxidanyl-butanoic acid Openeye Name: 3-hydroxy-2-[(1-methyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)amino]butanoic acid CAS Name: 3-hydroxy-2-[[[1-methyl-5-(1-pyrrolyl)-4-pyrazolyl]-oxomethyl]amino]butanoic acid IUPAC Name: 3-hydroxy-2-[(1-methyl-5-pyrrol-1-ylpyrazole-4-carbonyl)amino]butanoic acid Traditional Name: 3-hydroxy-2-[(1-methyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)amino]butyric acid Formula: C13H16N4O4 MolecularWeight: 292.29054

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N4O4/c1-8(18)10(13(20)21)15-11(19)9-7-14-16(2)12(9)17-5-3-4-6-17/h3-8,10,18H,1-2H3,(H,15,19)(H,20,21)