(2S)-1-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[(E)-1-oxo-3-(3,4,5-trimethoxyphenyl)prop-2-enyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-[(E)-3-(3,4,5-trimethoxyphenyl)acryloyl]proline Formula: C17H21NO6 MolecularWeight: 335.35174

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C=CC(=O)N2CCCC2C(=O)O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)/C=C/C(=O)N2CCC[C@H]2C(=O)O

InChI

InChI=1S/C17H21NO6/c1-22-13-9-11(10-14(23-2)16(13)24-3)6-7-15(19)18-8-4-5-12(18)17(20)21/h6-7,9-10,12H,4-5,8H2,1-3H3,(H,20,21)/b7-6+/t12-/m0/s1