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

Systemtic Name: 3-[[(E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoyl]amino]propanoic acid Openeye Name: 3-[[(E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoyl]amino]propanoic acid CAS Name: 3-[[(E)-1-oxo-3-(1,3,5-trimethyl-4-pyrazolyl)prop-2-enyl]amino]propanoic acid IUPAC Name: 3-[[(E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoyl]amino]propanoic acid Traditional Name: 3-[[(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)NCCC(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C12H17N3O3/c1-8-10(9(2)15(3)14-8)4-5-11(16)13-7-6-12(17)18/h4-5H,6-7H2,1-3H3,(H,13,16)(H,17,18)/b5-4+