4-methoxy-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 4-methoxy-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]pyrrolidine-2-carboxylic acid Openeye Name: 4-methoxy-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]pyrrolidine-2-carboxylic acid CAS Name: 4-methoxy-1-[(E)-3-(1-methyl-4-pyrazolyl)-1-oxoprop-2-enyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 4-methoxy-1-[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]pyrrolidine-2-carboxylic acid Traditional Name: 4-methoxy-1-[(E)-3-(1-methylpyrazol-4-yl)acryloyl]proline Formula: C13H17N3O4 MolecularWeight: 279.29178

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C=CC(=O)N2CC(CC2C(=O)O)OC

Isomeric SMILES

CN1C=C(C=N1)/C=C/C(=O)N2CC(CC2C(=O)O)OC

InChI

InChI=1S/C13H17N3O4/c1-15-7-9(6-14-15)3-4-12(17)16-8-10(20-2)5-11(16)13(18)19/h3-4,6-7,10-11H,5,8H2,1-2H3,(H,18,19)/b4-3+