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

Systemtic Name: 3-methyl-2-[[(E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoyl]amino]butanoic acid Openeye Name: 3-methyl-2-[[(E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoyl]amino]butanoic acid CAS Name: 3-methyl-2-[[(E)-1-oxo-3-(1,3,5-trimethyl-4-pyrazolyl)prop-2-enyl]amino]butanoic acid IUPAC Name: 3-methyl-2-[[(E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoyl]amino]butanoic acid Traditional Name: 3-methyl-2-[[(E)-3-(1,3,5-trimethylpyrazol-4-yl)acryloyl]amino]butyric acid Formula: C14H21N3O3 MolecularWeight: 279.33484

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O3/c1-8(2)13(14(19)20)15-12(18)7-6-11-9(3)16-17(5)10(11)4/h6-8,13H,1-5H3,(H,15,18)(H,19,20)/b7-6+