2-(2,4-dichlorophenyl)-3-ethoxy-4-methoxy-2-(phenylcarbonyl)piperazine-1-carboxylic acid

Systemtic Name: 2-(2,4-dichlorophenyl)-3-ethoxy-4-methoxy-2-(phenylcarbonyl)piperazine-1-carboxylic acid Openeye Name: 2-benzoyl-2-(2,4-dichlorophenyl)-3-ethoxy-4-methoxy-piperazine-1-carboxylic acid CAS Name: 2-benzoyl-2-(2,4-dichlorophenyl)-3-ethoxy-4-methoxy-1-piperazinecarboxylic acid IUPAC Name: 2-benzoyl-2-(2,4-dichlorophenyl)-3-ethoxy-4-methoxypiperazine-1-carboxylic acid Traditional Name: 2-benzoyl-2-(2,4-dichlorophenyl)-3-ethoxy-4-methoxy-piperazine-1-carboxylic acid Formula: C21H22Cl2N2O5 MolecularWeight: 453.31578

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1C(N(CCN1OC)C(=O)O)(C2=C(C=C(C=C2)Cl)Cl)C(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC1C(N(CCN1OC)C(=O)O)(C2=C(C=C(C=C2)Cl)Cl)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H22Cl2N2O5/c1-3-30-19-21(16-10-9-15(22)13-17(16)23,18(26)14-7-5-4-6-8-14)24(20(27)28)11-12-25(19)29-2/h4-10,13,19H,3,11-12H2,1-2H3,(H,27,28)