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

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

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

Isomeric SMILES

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

InChI

InChI=1S/C11H15N3O3/c1-3-9(11(16)17)13-10(15)5-4-8-6-12-14(2)7-8/h4-7,9H,3H2,1-2H3,(H,13,15)(H,16,17)/b5-4+