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

Systemtic Name: 2-[[(E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoyl]amino]hexanoic acid Openeye Name: 2-[[(E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoyl]amino]hexanoic acid CAS Name: 2-[[(E)-1-oxo-3-(1,3,5-trimethyl-4-pyrazolyl)prop-2-enyl]amino]hexanoic acid IUPAC Name: 2-[[(E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoyl]amino]hexanoic acid Traditional Name: 2-[[(E)-3-(1,3,5-trimethylpyrazol-4-yl)acryloyl]amino]hexanoic acid Formula: C15H23N3O3 MolecularWeight: 293.36142

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)NC(=O)C=CC1=C(N(N=C1C)C)C

Isomeric SMILES

CCCCC(C(=O)O)NC(=O)/C=C/C1=C(N(N=C1C)C)C

InChI

InChI=1S/C15H23N3O3/c1-5-6-7-13(15(20)21)16-14(19)9-8-12-10(2)17-18(4)11(12)3/h8-9,13H,5-7H2,1-4H3,(H,16,19)(H,20,21)/b9-8+