6-[[4-[2-(4-bromophenyl)-2-oxidanylidene-ethoxy]carbonylphenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 6-[[4-[2-(4-bromophenyl)-2-oxidanylidene-ethoxy]carbonylphenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-[[4-[2-(4-bromophenyl)-2-oxo-ethoxy]carbonylphenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[[4-[[2-(4-bromophenyl)-2-oxoethoxy]-oxomethyl]anilino]-oxomethyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-[[4-[2-(4-bromophenyl)-2-oxoethoxy]carbonylphenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid Traditional Name: 6-[[4-[2-(4-bromophenyl)-2-keto-ethoxy]carbonylphenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid Formula: C23H20BrNO6 MolecularWeight: 486.312

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC(C1C(=O)NC2=CC=C(C=C2)C(=O)OCC(=O)C3=CC=C(C=C3)Br)C(=O)O

Isomeric SMILES

C1C=CCC(C1C(=O)NC2=CC=C(C=C2)C(=O)OCC(=O)C3=CC=C(C=C3)Br)C(=O)O

InChI

InChI=1S/C23H20BrNO6/c24-16-9-5-14(6-10-16)20(26)13-31-23(30)15-7-11-17(12-8-15)25-21(27)18-3-1-2-4-19(18)22(28)29/h1-2,5-12,18-19H,3-4,13H2,(H,25,27)(H,28,29)