3-[4-[1-(2-carboxyethyl)-3-methyl-pyrazol-4-yl]selanyl-3-methyl-pyrazol-1-yl]propanoic acid

Systemtic Name: 3-[4-[1-(2-carboxyethyl)-3-methyl-pyrazol-4-yl]selanyl-3-methyl-pyrazol-1-yl]propanoic acid Openeye Name: 3-[4-[1-(2-carboxyethyl)-3-methyl-pyrazol-4-yl]selanyl-3-methyl-pyrazol-1-yl]propanoic acid CAS Name: 3-[4-[[1-(2-carboxyethyl)-3-methyl-4-pyrazolyl]seleno]-3-methyl-1-pyrazolyl]propanoic acid IUPAC Name: 3-[4-[1-(2-carboxyethyl)-3-methylpyrazol-4-yl]selanyl-3-methylpyrazol-1-yl]propanoic acid Traditional Name: 3-[4-[[1-(2-carboxyethyl)-3-methyl-pyrazol-4-yl]seleno]-3-methyl-pyrazol-1-yl]propionic acid Formula: C14H18N4O4Se MolecularWeight: 385.27712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1[Se]C2=CN(N=C2C)CCC(=O)O)CCC(=O)O

Isomeric SMILES

CC1=NN(C=C1[Se]C2=CN(N=C2C)CCC(=O)O)CCC(=O)O

InChI

InChI=1S/C14H18N4O4Se/c1-9-11(7-17(15-9)5-3-13(19)20)23-12-8-18(16-10(12)2)6-4-14(21)22/h7-8H,3-6H2,1-2H3,(H,19,20)(H,21,22)