1-[2-benzamido-3-(4-fluorophenyl)prop-2-enoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-benzamido-3-(4-fluorophenyl)prop-2-enoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-benzamido-3-(4-fluorophenyl)prop-2-enoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-benzamido-3-(4-fluorophenyl)-1-oxoprop-2-enyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-benzamido-3-(4-fluorophenyl)prop-2-enoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-benzamido-3-(4-fluorophenyl)acryloyl]proline Formula: C21H19FN2O4 MolecularWeight: 382.384963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(=CC2=CC=C(C=C2)F)NC(=O)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(=O)C(=CC2=CC=C(C=C2)F)NC(=O)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C21H19FN2O4/c22-16-10-8-14(9-11-16)13-17(23-19(25)15-5-2-1-3-6-15)20(26)24-12-4-7-18(24)21(27)28/h1-3,5-6,8-11,13,18H,4,7,12H2,(H,23,25)(H,27,28)