2-ethanoyl-3-(3-fluorophenyl)-2-prop-2-enoyl-piperazine-1-carboxylic acid

Systemtic Name: 2-ethanoyl-3-(3-fluorophenyl)-2-prop-2-enoyl-piperazine-1-carboxylic acid Openeye Name: 2-acetyl-3-(3-fluorophenyl)-2-prop-2-enoyl-piperazine-1-carboxylic acid CAS Name: 2-acetyl-3-(3-fluorophenyl)-2-(1-oxoprop-2-enyl)-1-piperazinecarboxylic acid IUPAC Name: 2-acetyl-3-(3-fluorophenyl)-2-prop-2-enoylpiperazine-1-carboxylic acid Traditional Name: 2-acetyl-2-acryloyl-3-(3-fluorophenyl)piperazine-1-carboxylic acid Formula: C16H17FN2O4 MolecularWeight: 320.315583

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1(C(NCCN1C(=O)O)C2=CC(=CC=C2)F)C(=O)C=C

Isomeric SMILES

CC(=O)C1(C(NCCN1C(=O)O)C2=CC(=CC=C2)F)C(=O)C=C

InChI

InChI=1S/C16H17FN2O4/c1-3-13(21)16(10(2)20)14(11-5-4-6-12(17)9-11)18-7-8-19(16)15(22)23/h3-6,9,14,18H,1,7-8H2,2H3,(H,22,23)