2-[4-oxidanylidene-2-phenethyl-4-[2,2,2-tris(chloranyl)ethoxy]butanoyl]piperazine-1-carboxylate

Systemtic Name: 2-[4-oxidanylidene-2-phenethyl-4-[2,2,2-tris(chloranyl)ethoxy]butanoyl]piperazine-1-carboxylate Openeye Name: 2-[4-oxo-2-phenethyl-4-(2,2,2-trichloroethoxy)butanoyl]piperazine-1-carboxylate CAS Name: 2-[1,4-dioxo-2-phenethyl-4-(2,2,2-trichloroethoxy)butyl]-1-piperazinecarboxylate IUPAC Name: 2-[4-oxo-2-phenethyl-4-(2,2,2-trichloroethoxy)butanoyl]piperazine-1-carboxylate Traditional Name: 2-[4-keto-2-phenethyl-4-(2,2,2-trichloroethoxy)butanoyl]piperazine-1-carboxylate Formula: C19H22Cl3N2O5- MolecularWeight: 464.74738

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1)C(=O)C(CCC2=CC=CC=C2)CC(=O)OCC(Cl)(Cl)Cl)C(=O)[O-]

Isomeric SMILES

C1CN(C(CN1)C(=O)C(CCC2=CC=CC=C2)CC(=O)OCC(Cl)(Cl)Cl)C(=O)[O-]

InChI

InChI=1S/C19H23Cl3N2O5/c20-19(21,22)12-29-16(25)10-14(7-6-13-4-2-1-3-5-13)17(26)15-11-23-8-9-24(15)18(27)28/h1-5,14-15,23H,6-12H2,(H,27,28)/p-1