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

Systemtic Name: 4-methoxy-1-[(E)-3-(3-methylphenyl)prop-2-enoyl]pyrrolidine-2-carboxylic acid Openeye Name: 4-methoxy-1-[(E)-3-(m-tolyl)prop-2-enoyl]pyrrolidine-2-carboxylic acid CAS Name: 4-methoxy-1-[(E)-3-(3-methylphenyl)-1-oxoprop-2-enyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 4-methoxy-1-[(E)-3-(3-methylphenyl)prop-2-enoyl]pyrrolidine-2-carboxylic acid Traditional Name: 4-methoxy-1-[(E)-3-(m-tolyl)acryloyl]proline Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C=CC(=O)N2CC(CC2C(=O)O)OC

Isomeric SMILES

CC1=CC=CC(=C1)/C=C/C(=O)N2CC(CC2C(=O)O)OC

InChI

InChI=1S/C16H19NO4/c1-11-4-3-5-12(8-11)6-7-15(18)17-10-13(21-2)9-14(17)16(19)20/h3-8,13-14H,9-10H2,1-2H3,(H,19,20)/b7-6+