4-(4-phenoxyphenyl)-4-(4-phenylbutylcarbamoyl)-1,3-dioxolane-2,2-dicarboxylic acid

Systemtic Name: 4-(4-phenoxyphenyl)-4-(4-phenylbutylcarbamoyl)-1,3-dioxolane-2,2-dicarboxylic acid Openeye Name: 4-(4-phenoxyphenyl)-4-(4-phenylbutylcarbamoyl)-1,3-dioxolane-2,2-dicarboxylic acid CAS Name: 4-[oxo-(4-phenylbutylamino)methyl]-4-(4-phenoxyphenyl)-1,3-dioxolane-2,2-dicarboxylic acid IUPAC Name: 4-(4-phenoxyphenyl)-4-(4-phenylbutylcarbamoyl)-1,3-dioxolane-2,2-dicarboxylic acid Traditional Name: 4-(4-phenoxyphenyl)-4-(4-phenylbutylcarbamoyl)-1,3-dioxolane-2,2-dicarboxylic acid Formula: C28H27NO8 MolecularWeight: 505.51588

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(O1)(C(=O)O)C(=O)O)(C2=CC=C(C=C2)OC3=CC=CC=C3)C(=O)NCCCCC4=CC=CC=C4

Isomeric SMILES

C1C(OC(O1)(C(=O)O)C(=O)O)(C2=CC=C(C=C2)OC3=CC=CC=C3)C(=O)NCCCCC4=CC=CC=C4

InChI

InChI=1S/C28H27NO8/c30-24(29-18-8-7-11-20-9-3-1-4-10-20)27(19-35-28(37-27,25(31)32)26(33)34)21-14-16-23(17-15-21)36-22-12-5-2-6-13-22/h1-6,9-10,12-17H,7-8,11,18-19H2,(H,29,30)(H,31,32)(H,33,34)