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

Systemtic Name: 1-[(E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoyl]piperidine-4-carboxylic acid Openeye Name: 1-[(E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoyl]piperidine-4-carboxylic acid CAS Name: 1-[(E)-1-oxo-3-(1,3,5-trimethyl-4-pyrazolyl)prop-2-enyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoyl]piperidine-4-carboxylic acid Traditional Name: 1-[(E)-3-(1,3,5-trimethylpyrazol-4-yl)acryloyl]isonipecotic acid Formula: C15H21N3O3 MolecularWeight: 291.34554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C=CC(=O)N2CCC(CC2)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1C)C)/C=C/C(=O)N2CCC(CC2)C(=O)O

InChI

InChI=1S/C15H21N3O3/c1-10-13(11(2)17(3)16-10)4-5-14(19)18-8-6-12(7-9-18)15(20)21/h4-5,12H,6-9H2,1-3H3,(H,20,21)/b5-4+