1-[(E)-3-(2-bromanyl-4-methyl-phenyl)prop-2-enoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(E)-3-(2-bromanyl-4-methyl-phenyl)prop-2-enoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(E)-3-(2-bromo-4-methyl-phenyl)prop-2-enoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(E)-3-(2-bromo-4-methylphenyl)-1-oxoprop-2-enyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(E)-3-(2-bromo-4-methylphenyl)prop-2-enoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(E)-3-(2-bromo-4-methyl-phenyl)acryloyl]proline Formula: C15H16BrNO3 MolecularWeight: 338.19644

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16BrNO3/c1-10-4-5-11(12(16)9-10)6-7-14(18)17-8-2-3-13(17)15(19)20/h4-7,9,13H,2-3,8H2,1H3,(H,19,20)/b7-6+