3-[5-[(4-bromanyl-2-methyl-pyrazol-3-yl)methyl-methyl-carbamoyl]pyrazol-1-yl]propanoic acid

Systemtic Name: 3-[5-[(4-bromanyl-2-methyl-pyrazol-3-yl)methyl-methyl-carbamoyl]pyrazol-1-yl]propanoic acid Openeye Name: 3-[5-[(4-bromo-2-methyl-pyrazol-3-yl)methyl-methyl-carbamoyl]pyrazol-1-yl]propanoic acid CAS Name: 3-[5-[[(4-bromo-2-methyl-3-pyrazolyl)methyl-methylamino]-oxomethyl]-1-pyrazolyl]propanoic acid IUPAC Name: 3-[5-[(4-bromo-2-methylpyrazol-3-yl)methyl-methylcarbamoyl]pyrazol-1-yl]propanoic acid Traditional Name: 3-[5-[(4-bromo-2-methyl-pyrazol-3-yl)methyl-methyl-carbamoyl]pyrazol-1-yl]propionic acid Formula: C13H16BrN5O3 MolecularWeight: 370.20184

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)Br)CN(C)C(=O)C2=CC=NN2CCC(=O)O

Isomeric SMILES

CN1C(=C(C=N1)Br)CN(C)C(=O)C2=CC=NN2CCC(=O)O

InChI

InChI=1S/C13H16BrN5O3/c1-17(8-11-9(14)7-16-18(11)2)13(22)10-3-5-15-19(10)6-4-12(20)21/h3,5,7H,4,6,8H2,1-2H3,(H,20,21)