2-[[(E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoyl]amino]propanoic acid

Systemtic Name: 2-[[(E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoyl]amino]propanoic acid Openeye Name: 2-[[(E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoyl]amino]propanoic acid CAS Name: 2-[[(E)-1-oxo-3-(1,3,5-trimethyl-4-pyrazolyl)prop-2-enyl]amino]propanoic acid IUPAC Name: 2-[[(E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoyl]amino]propanoic acid Traditional Name: 2-[[(E)-3-(1,3,5-trimethylpyrazol-4-yl)acryloyl]amino]propionic acid Formula: C12H17N3O3 MolecularWeight: 251.28168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C=CC(=O)NC(C)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1C)C)/C=C/C(=O)NC(C)C(=O)O

InChI

InChI=1S/C12H17N3O3/c1-7-10(9(3)15(4)14-7)5-6-11(16)13-8(2)12(17)18/h5-6,8H,1-4H3,(H,13,16)(H,17,18)/b6-5+