1-[(E)-3-(2,4-dimethylphenyl)prop-2-enoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(E)-3-(2,4-dimethylphenyl)prop-2-enoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(E)-3-(2,4-dimethylphenyl)prop-2-enoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(E)-3-(2,4-dimethylphenyl)-1-oxoprop-2-enyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(E)-3-(2,4-dimethylphenyl)prop-2-enoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(E)-3-(2,4-dimethylphenyl)acryloyl]proline Formula: C16H19NO3 MolecularWeight: 273.32696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C=CC(=O)N2CCCC2C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C=C1)/C=C/C(=O)N2CCCC2C(=O)O)C

InChI

InChI=1S/C16H19NO3/c1-11-5-6-13(12(2)10-11)7-8-15(18)17-9-3-4-14(17)16(19)20/h5-8,10,14H,3-4,9H2,1-2H3,(H,19,20)/b8-7+