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

Systemtic Name: 3-[[(E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoyl]amino]butanoic acid Openeye Name: 3-[[(E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoyl]amino]butanoic acid CAS Name: 3-[[(E)-1-oxo-3-(1,3,5-trimethyl-4-pyrazolyl)prop-2-enyl]amino]butanoic acid IUPAC Name: 3-[[(E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoyl]amino]butanoic acid Traditional Name: 3-[[(E)-3-(1,3,5-trimethylpyrazol-4-yl)acryloyl]amino]butyric acid Formula: C13H19N3O3 MolecularWeight: 265.30826

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19N3O3/c1-8(7-13(18)19)14-12(17)6-5-11-9(2)15-16(4)10(11)3/h5-6,8H,7H2,1-4H3,(H,14,17)(H,18,19)/b6-5+