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

Systemtic Name: 3-[[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]amino]butanoic acid Openeye Name: 3-[[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]amino]butanoic acid CAS Name: 3-[[(E)-3-(1-methyl-4-pyrazolyl)-1-oxoprop-2-enyl]amino]butanoic acid IUPAC Name: 3-[[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]amino]butanoic acid Traditional Name: 3-[[(E)-3-(1-methylpyrazol-4-yl)acryloyl]amino]butyric acid Formula: C11H15N3O3 MolecularWeight: 237.2551

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)NC(=O)C=CC1=CN(N=C1)C

Isomeric SMILES

CC(CC(=O)O)NC(=O)/C=C/C1=CN(N=C1)C

InChI

InChI=1S/C11H15N3O3/c1-8(5-11(16)17)13-10(15)4-3-9-6-12-14(2)7-9/h3-4,6-8H,5H2,1-2H3,(H,13,15)(H,16,17)/b4-3+