3-[3,5-bis(chloranyl)phenyl]-2-ethanoyl-2-prop-2-enoyl-piperazine-1-carboxylic acid

Systemtic Name: 3-[3,5-bis(chloranyl)phenyl]-2-ethanoyl-2-prop-2-enoyl-piperazine-1-carboxylic acid Openeye Name: 2-acetyl-3-(3,5-dichlorophenyl)-2-prop-2-enoyl-piperazine-1-carboxylic acid CAS Name: 2-acetyl-3-(3,5-dichlorophenyl)-2-(1-oxoprop-2-enyl)-1-piperazinecarboxylic acid IUPAC Name: 2-acetyl-3-(3,5-dichlorophenyl)-2-prop-2-enoylpiperazine-1-carboxylic acid Traditional Name: 2-acetyl-2-acryloyl-3-(3,5-dichlorophenyl)piperazine-1-carboxylic acid Formula: C16H16Cl2N2O4 MolecularWeight: 371.21524

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16Cl2N2O4/c1-3-13(22)16(9(2)21)14(19-4-5-20(16)15(23)24)10-6-11(17)8-12(18)7-10/h3,6-8,14,19H,1,4-5H2,2H3,(H,23,24)