O4-[(1S,2R,5S)-5-methyl-2-propan-2-yl-cyclohexyl] O1-[2-oxidanylidene-2-(4-phenylphenyl)ethyl] butanedioate

Systemtic Name: O4-[(1S,2R,5S)-5-methyl-2-propan-2-yl-cyclohexyl] O1-[2-oxidanylidene-2-(4-phenylphenyl)ethyl] butanedioate Openeye Name: O4-[(1S,2R,5S)-2-isopropyl-5-methyl-cyclohexyl] O1-[2-oxo-2-(4-phenylphenyl)ethyl] butanedioate CAS Name: butanedioic acid O4-[(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl] ester O1-[2-oxo-2-(4-phenylphenyl)ethyl] ester IUPAC Name: 4-O-[(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl] 1-O-[2-oxo-2-(4-phenylphenyl)ethyl] butanedioate Traditional Name: succinic acid O4-[(1S,2R,5S)-2-isopropyl-5-methyl-cyclohexyl] ester O1-[2-keto-2-(4-phenylphenyl)ethyl] ester Formula: C28H34O5 MolecularWeight: 450.56656

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)CCC(=O)OCC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)C(C)C

Isomeric SMILES

C[C@H]1CC[C@@H]([C@H](C1)OC(=O)CCC(=O)OCC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)C(C)C

InChI

InChI=1S/C28H34O5/c1-19(2)24-14-9-20(3)17-26(24)33-28(31)16-15-27(30)32-18-25(29)23-12-10-22(11-13-23)21-7-5-4-6-8-21/h4-8,10-13,19-20,24,26H,9,14-18H2,1-3H3/t20-,24+,26-/m0/s1