4-(2,2-diphenylethanoyl)-1-(4-fluorophenyl)sulfonyl-piperazine-2-carboxylic acid

Systemtic Name: 4-(2,2-diphenylethanoyl)-1-(4-fluorophenyl)sulfonyl-piperazine-2-carboxylic acid Openeye Name: 4-(2,2-diphenylacetyl)-1-(4-fluorophenyl)sulfonyl-piperazine-2-carboxylic acid CAS Name: 1-(4-fluorophenyl)sulfonyl-4-(1-oxo-2,2-diphenylethyl)-2-piperazinecarboxylic acid IUPAC Name: 4-(2,2-diphenylacetyl)-1-(4-fluorophenyl)sulfonylpiperazine-2-carboxylic acid Traditional Name: 4-(2,2-diphenylacetyl)-1-(4-fluorophenyl)sulfonyl-piperazine-2-carboxylic acid Formula: C25H23FN2O5S MolecularWeight: 482.523923

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1C(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)O)S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(C(CN1C(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)O)S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H23FN2O5S/c26-20-11-13-21(14-12-20)34(32,33)28-16-15-27(17-22(28)25(30)31)24(29)23(18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-14,22-23H,15-17H2,(H,30,31)